prompt string | completion string | split string | pair_id string | ranking_query_id string | ranking_member_index int64 | ranking_candidate_row_count int64 | ranking_candidate_parent_count int64 | retrieval_parent_rank int64 | retrieval_parent_context_index int64 | retrieval_parent_context_count int64 | task_id string | source_id string | retrieval_strategy string | query_record_id string | retrieval_record_id string | query_benchmark_row_id string | retrieval_benchmark_row_id string | query_molecule_identity_key string | retrieval_molecule_identity_key string | query_smiles string | retrieval_smiles string | query_condition_group string | retrieval_condition_group string | query_condition_scope string | retrieval_condition_scope string | query_condition_atoms list | retrieval_condition_atoms list | candidate_context_relation string | query_source_record_count int64 | retrieval_source_record_count int64 | query_agreement_fraction float64 | retrieval_agreement_fraction float64 | query_gold_Y int64 | retrieval_gold_Y int64 | ranking_balance_label string | query_geometry_value float64 | retrieval_geometry_value float64 | absolute_geometry_difference float64 | calibration_sample_standard_deviation float64 | target_distribution dict | canonical_endpoint_key string | assay_concept string | measurement_kind string | metadata dict | absolute_canonical_value_difference float64 | standardized_canonical_value_difference float64 | sd_logistic_similarity float64 | target_train_sample_standard_deviation float64 | target_a float64 | target_b float64 | label_mode string | binary_label int64 | is_decisive bool | morgan_tanimoto_similarity float64 | graph_a_position int64 | graph_b_position int64 | graph_offset int64 | representation string | pair_bucket_key string | query_parent_id string | retrieval_parent_id string | query_scaffold string | retrieval_scaffold string | query_evidence dict | retrieval_evidence dict | bucket_total_record_count int64 | bucket_train_record_count int64 | bucket_train_parent_count int64 | evaluation_regime string | calibration_scope string | logit_geometry_transform string | query_source_payload_json string | retrieval_source_payload_json string | level string | level_family string | query_source_row_uid string | retrieval_source_row_uid string | upstream_pair_bucket_key string |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>O=S(=O)(c1ccccc1)N(CC(F)(F)F)c1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Male C57BL/6J mice, 2-3 months old, in vivo; m... | (A) | train | 367b12d648de5d61ba0c0b08a94d46d3cf72f18d92e1d733e7ada134b8a0c944 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:e95b60eec6736d3b87d0d1a110d065283935c315862ab97eab1215d5ccceb86f | dili:51532c46b483b0f9a8d73b49375551eea075129f5de34ea06c719c95ac522f90 | dili:e95b60eec6736d3b87d0d1a110d065283935c315862ab97eab1215d5ccceb86f | dili:51532c46b483b0f9a8d73b49375551eea075129f5de34ea06c719c95ac522f90 | XOAAWQZATWQOTB-UHFFFAOYSA-N | SGIWFELWJPNFDH-UHFFFAOYSA-N | NCCS(=O)(=O)O | O=S(=O)(c1ccccc1)N(CC(F)(F)F)c1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=APAP-treated hamsters (Mesocricetus auratus), in vivo, three to six animals per group; intact in vivo system, intrinsically metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric... | [
"assay_format=in_vivo_animal",
"biological_system_context=Male C57BL/6J mice, 2-3 months old, in vivo; metabolic competence: intact in vivo (intrinsically competent)",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliar... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 7.72 | 7.8 | 0.08 | 5.5845 | {
"nontransfer": 0.020699148178055293,
"transfer": 0.9793008518219447
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 0.08 | 0.014325 | 0.979301 | 5.5845 | 0.979301 | 0.020699 | safety_canonical_v27 | 1 | true | 0.108696 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | XOAAWQZATWQOTB-UHFFFAOYSA-N | SGIWFELWJPNFDH-UHFFFAOYSA-N | parent:XOAAWQZATWQOTB-UHFFFAOYSA-N | O=S(=O)(Nc1ccccc1)c1ccccc1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.72",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.72,
"aggregate_max": 7.72,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.8",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.8,
"aggregate_max": 7.8,
"aggregate_q1": ... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"APAP-treated hamsters (Mesocricetus auratus), in vivo, three to six animals per group; intact in vivo system, intrinsically metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.75,"effe... | {"assay_format":"in_vivo_animal","biological_system_context":"Male C57BL/6J mice, 2-3 months old, in vivo; metabolic competence: intact in vivo (intrinsically competent)","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"no_change","endpoint_metric... | L4 | gold_v1 | sr_dd3de8c090584b9d9289080b8289b1a5 | sr_6140b053a4284068ba3638c97504989b | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>NCCC(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rattus norvegicus, in vivo bile collection, bile-salt-free isotope studies, β-alanine pretreated r... | (B) | train | 4357f774729ec0a666bee512cb67925905ca3660b842a747763dbe7ce9ffa7c5 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:642f46db98fcfefd64b860bfa2d29ab4e81b49349142e96c276dc0184d6017ef | dili:5efdf6a9f460b4828ceaf1c93eb1b3a761f982e94766e34784424d001483ec37 | dili:642f46db98fcfefd64b860bfa2d29ab4e81b49349142e96c276dc0184d6017ef | dili:5efdf6a9f460b4828ceaf1c93eb1b3a761f982e94766e34784424d001483ec37 | DNIAPMSPPWPWGF-UHFFFAOYSA-N | UCMIRNVEIXFBKS-UHFFFAOYSA-N | CC(O)CO | NCCC(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile-acid-independent ... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rattus norvegicus, in vivo bile collection, bile-salt-free isotope studies, β-alanine pretreated rats versus control rats",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoi... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 4.79 | 21.95 | 17.16 | 5.5845 | {
"nontransfer": 0.9999999999975328,
"transfer": 2.4672732875983316e-12
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 17.16 | 3.072791 | 0 | 5.5845 | 0 | 1 | safety_canonical_v27 | 0 | true | 0.095238 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | DNIAPMSPPWPWGF-UHFFFAOYSA-N | UCMIRNVEIXFBKS-UHFFFAOYSA-N | parent:DNIAPMSPPWPWGF-UHFFFAOYSA-N | parent:UCMIRNVEIXFBKS-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.79",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.79,
"aggregate_max": 4.79,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "21.95",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 21.95,
"aggregate_max": 21.95,
"aggregate... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"no_change... | {"assay_format":"in_vivo_animal","biological_system_context":"Rattus norvegicus, in vivo bile collection, bile-salt-free isotope studies, \u03b2-alanine pretreated rats versus control rats","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.8,"effect_direction":"increase... | L4 | gold_v1 | sr_b051effdb7c548f7ac1a6aa1a01994a4 | sr_a1ac8787621642a595cf64eb57aa3bf9 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: In vivo male... | (B) | train | b3b558b7e1f8d68459a27b2f5005f54ff74eade67591dcf851bc5ed9005f8753 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:32689c2b57e4228d1a9519ea72deb8452513798897810c8dd6f15cfefe32a277 | dili:585216628833c092b974ed7686b0d83aa37d683d966c2bc8891183857cdba3f3 | dili:32689c2b57e4228d1a9519ea72deb8452513798897810c8dd6f15cfefe32a277 | dili:585216628833c092b974ed7686b0d83aa37d683d966c2bc8891183857cdba3f3 | YPHMISFOHDHNIV-FSZOTQKASA-N | DKPMWHFRUGMUKF-GDYCBZMLSA-N | C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1 | C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_me... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 4.06 | 18.76 | 14.7 | 9.325017 | {
"nontransfer": 0.9999922207778621,
"transfer": 0.000007779222137872104
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 14.7 | 1.576405 | 0.000008 | 9.325017 | 0.000008 | 0.999992 | safety_canonical_v27 | 0 | true | 0.15942 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | YPHMISFOHDHNIV-FSZOTQKASA-N | DKPMWHFRUGMUKF-GDYCBZMLSA-N | O=C1CC(CCC2CCCCC2=O)CC(=O)N1 | C1CCC2C(C1)CCC1C3CCCC3CCC21 | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.06",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.06,
"aggregate_max": 4.06,
"aggregate_q1": 4.06,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "18.76",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 18.76,
"aggregate_max": 18.76,
"aggregate_q1": 18.76,... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase","endpoint_metric":"bile flow rate","endp... | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"... | L4 | gold_v1 | sr_d2a6f3c9e2c444fd94496ea3fdd30f9e | sr_2e7e6b62948e4bee8840080aec5c1f56 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>NCCC(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rattus norvegicus, in vivo bile collection, bile-salt-free isotope studies, β-alanine pretreated r... | (B) | train | 508d1da3572c82b3ab870edfebdf37a08e34d79913ffb0939bb50151f4b6072d | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:3b7fbe8e584b862aef792235b051e8922b1d110d451c2852bf679ea6aeb04779 | dili:5efdf6a9f460b4828ceaf1c93eb1b3a761f982e94766e34784424d001483ec37 | dili:3b7fbe8e584b862aef792235b051e8922b1d110d451c2852bf679ea6aeb04779 | dili:5efdf6a9f460b4828ceaf1c93eb1b3a761f982e94766e34784424d001483ec37 | MUBZPKHOEPUJKR-UHFFFAOYSA-N | UCMIRNVEIXFBKS-UHFFFAOYSA-N | O=C(O)C(=O)O | NCCC(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo with biliary collection; co-infused bile salts given intravenously; metabolically competent intact system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rattus norvegicus, in vivo bile collection, bile-salt-free isotope studies, β-alanine pretreated rats versus control rats",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoi... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 8.57 | 21.95 | 13.38 | 5.5845 | {
"nontransfer": 0.9999999978529535,
"transfer": 2.1470465456579016e-9
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 13.38 | 2.395917 | 0 | 5.5845 | 0 | 1 | safety_canonical_v27 | 0 | true | 0.266667 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | MUBZPKHOEPUJKR-UHFFFAOYSA-N | UCMIRNVEIXFBKS-UHFFFAOYSA-N | parent:MUBZPKHOEPUJKR-UHFFFAOYSA-N | parent:UCMIRNVEIXFBKS-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "8.57",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 8.57,
"aggregate_max": 8.57,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "21.95",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 21.95,
"aggregate_max": 21.95,
"aggregate... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo with biliary collection; co-infused bile salts given intravenously; metabolically competent intact system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_directi... | {"assay_format":"in_vivo_animal","biological_system_context":"Rattus norvegicus, in vivo bile collection, bile-salt-free isotope studies, \u03b2-alanine pretreated rats versus control rats","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.8,"effect_direction":"increase... | L4 | gold_v1 | sr_1e5923f03ece45689f88a1bd7f47a771 | sr_a1ac8787621642a595cf64eb57aa3bf9 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus) in viv... | (B) | train | 26c7d1192d7c3c31161686049e8c1648361779ebab5a49a2b50c7b6c212c638b | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:6293265c0525f91cec51f01a12c2c59d8c90200c1337eedfb51a47c8937bb65d | dili:182e1713eb9965d45677af92b3e9f1e05f2bd9cce55eea95950a5c4623b57081 | dili:6293265c0525f91cec51f01a12c2c59d8c90200c1337eedfb51a47c8937bb65d | dili:182e1713eb9965d45677af92b3e9f1e05f2bd9cce55eea95950a5c4623b57081 | XAGFODPZIPBFFR-UHFFFAOYSA-N | MECYMOKOKLARJV-PCNQZJBLSA-N | [Al] | C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Adult rats (Rattus norvegicus), in vivo, intact organism; Al-intoxication model; bile flow collected under basal conditions.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"end... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 4.25 | 0.27 | 3.98 | 5.5845 | {
"nontransfer": 0.9579875585110286,
"transfer": 0.042012441488971396
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 3.98 | 0.712687 | 0.042012 | 5.5845 | 0.042012 | 0.957988 | safety_canonical_v27 | 0 | true | 0 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | XAGFODPZIPBFFR-UHFFFAOYSA-N | MECYMOKOKLARJV-PCNQZJBLSA-N | parent:XAGFODPZIPBFFR-UHFFFAOYSA-N | C1=C2CCCCC2C2CCC3CCCC3C2C1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.25",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.25,
"aggregate_max": 4.25,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "0.27",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 0.27,
"aggregate_max": 0.27,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Adult rats (Rattus norvegicus), in vivo, intact organism; Al-intoxication model; bile flow collected under basal conditions.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"decrease",... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"decrea... | L4 | gold_v1 | sr_5829e25f0c084de3a9890aecb7e138c8 | sr_5916d18874cd46a487a6aef7541223af | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>O=S(=O)(c1ccccc1)N(CC(F)(F)F)c1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Male C57BL/6J mice, 2-3 months old, in vivo; m... | (A) | train | 5b31f5acc37c270ed37a7a6f15c0d0ce9096652e19945ba0acc3276994ab407b | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:12ac9f43e5181b1a9d82fe21da0fb6145b6d579a65d1f315991994d183a60977 | dili:51532c46b483b0f9a8d73b49375551eea075129f5de34ea06c719c95ac522f90 | dili:12ac9f43e5181b1a9d82fe21da0fb6145b6d579a65d1f315991994d183a60977 | dili:51532c46b483b0f9a8d73b49375551eea075129f5de34ea06c719c95ac522f90 | DDBREPKUVSBGFI-UHFFFAOYSA-N | SGIWFELWJPNFDH-UHFFFAOYSA-N | CCC1(c2ccccc2)C(=O)NC(=O)NC1=O | O=S(=O)(c1ccccc1)N(CC(F)(F)F)c1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile-acid-independent ... | [
"assay_format=in_vivo_animal",
"biological_system_context=Male C57BL/6J mice, 2-3 months old, in vivo; metabolic competence: intact in vivo (intrinsically competent)",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliar... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 6.61 | 7.8 | 1.19 | 5.5845 | {
"nontransfer": 0.13364566452300097,
"transfer": 0.866354335476999
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 1.19 | 0.21309 | 0.866354 | 5.5845 | 0.866354 | 0.133646 | safety_canonical_v27 | 1 | true | 0.148148 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | DDBREPKUVSBGFI-UHFFFAOYSA-N | SGIWFELWJPNFDH-UHFFFAOYSA-N | O=C1NC(=O)C(c2ccccc2)C(=O)N1 | O=S(=O)(Nc1ccccc1)c1ccccc1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "6.61",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 6.61,
"aggregate_max": 6.61,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.8",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.8,
"aggregate_max": 7.8,
"aggregate_q1": ... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase"... | {"assay_format":"in_vivo_animal","biological_system_context":"Male C57BL/6J mice, 2-3 months old, in vivo; metabolic competence: intact in vivo (intrinsically competent)","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"no_change","endpoint_metric... | L4 | gold_v1 | sr_5f1a4bc38132448192f150870527230c | sr_6140b053a4284068ba3638c97504989b | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CC(O)CO</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as... | (A) | train | 285cb61729d846d904c34ec140c0626a69c39715d4feb7483cabcb40adf9b099 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:fdc0a5f33f0b9fee0aedc74bd2f7b99068b88362c0f38190e05bfc81aac2472a | dili:642f46db98fcfefd64b860bfa2d29ab4e81b49349142e96c276dc0184d6017ef | dili:fdc0a5f33f0b9fee0aedc74bd2f7b99068b88362c0f38190e05bfc81aac2472a | dili:642f46db98fcfefd64b860bfa2d29ab4e81b49349142e96c276dc0184d6017ef | XAGFODPZIPBFFR-UHFFFAOYSA-N | DNIAPMSPPWPWGF-UHFFFAOYSA-N | [Al] | CC(O)CO | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rattus norvegicus rats, chronic Al-intoxication model, in vivo basal bile collection, n=6; intrinsically metabolically competent in vivo system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bil... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile-acid-independent ... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 4.25 | 4.79 | 0.54 | 5.5845 | {
"nontransfer": 0.04595545192358885,
"transfer": 0.9540445480764111
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 0.54 | 0.096696 | 0.954045 | 5.5845 | 0.954045 | 0.045955 | safety_canonical_v27 | 1 | true | 0 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | XAGFODPZIPBFFR-UHFFFAOYSA-N | DNIAPMSPPWPWGF-UHFFFAOYSA-N | parent:XAGFODPZIPBFFR-UHFFFAOYSA-N | parent:DNIAPMSPPWPWGF-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.25",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.25,
"aggregate_max": 4.25,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.79",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.79,
"aggregate_max": 4.79,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rattus norvegicus rats, chronic Al-intoxication model, in vivo basal bile collection, n=6; intrinsically metabolically competent in vivo system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.88,"effect_d... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"no_change... | L4 | gold_v1 | sr_1447743d61614aa7b100609c04fb224c | sr_b051effdb7c548f7ac1a6aa1a01994a4 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>NCCS(=O)(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: APAP-treated hamsters (Mesocricetus auratus), in vivo, three to six animals per group; intact ... | (B) | train | b64ea15e29bbfe6b4b2eeaad45b1b7f2b43446db95ea56eb1c3ed592cc22aea3 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:5efdf6a9f460b4828ceaf1c93eb1b3a761f982e94766e34784424d001483ec37 | dili:e95b60eec6736d3b87d0d1a110d065283935c315862ab97eab1215d5ccceb86f | dili:5efdf6a9f460b4828ceaf1c93eb1b3a761f982e94766e34784424d001483ec37 | dili:e95b60eec6736d3b87d0d1a110d065283935c315862ab97eab1215d5ccceb86f | UCMIRNVEIXFBKS-UHFFFAOYSA-N | XOAAWQZATWQOTB-UHFFFAOYSA-N | NCCC(=O)O | NCCS(=O)(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rattus norvegicus, in vivo bile collection, bile-salt-free isotope studies, β-alanine pretreated rats versus control rats",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoi... | [
"assay_format=in_vivo_animal",
"biological_system_context=APAP-treated hamsters (Mesocricetus auratus), in vivo, three to six animals per group; intact in vivo system, intrinsically metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 21.95 | 7.72 | 14.23 | 5.5845 | {
"nontransfer": 0.9999999995313864,
"transfer": 4.686135624580185e-10
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 14.23 | 2.548124 | 0 | 5.5845 | 0 | 1 | safety_canonical_v27 | 0 | true | 0.285714 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | UCMIRNVEIXFBKS-UHFFFAOYSA-N | XOAAWQZATWQOTB-UHFFFAOYSA-N | parent:UCMIRNVEIXFBKS-UHFFFAOYSA-N | parent:XOAAWQZATWQOTB-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "21.95",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 21.95,
"aggregate_max": 21.95,
"aggregate... | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.72",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.72,
"aggregate_max": 7.72,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rattus norvegicus, in vivo bile collection, bile-salt-free isotope studies, \u03b2-alanine pretreated rats versus control rats","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.8,"effect_direction":"increase... | {"assay_format":"in_vivo_animal","biological_system_context":"APAP-treated hamsters (Mesocricetus auratus), in vivo, three to six animals per group; intact in vivo system, intrinsically metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.75,"effe... | L4 | gold_v1 | sr_a1ac8787621642a595cf64eb57aa3bf9 | sr_dd3de8c090584b9d9289080b8289b1a5 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CC(O)CO</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as... | (A) | train | 3d0113ffa4f9bd4a2224d788aba8a3bed3d7e7ffde2aaaa0fe6fa8b3599b473d | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:9efa179c73816a18f1a7e820124cab39565b7cf7e91fee502d68e5fed1f83075 | dili:642f46db98fcfefd64b860bfa2d29ab4e81b49349142e96c276dc0184d6017ef | dili:9efa179c73816a18f1a7e820124cab39565b7cf7e91fee502d68e5fed1f83075 | dili:642f46db98fcfefd64b860bfa2d29ab4e81b49349142e96c276dc0184d6017ef | GVJHHUAWPYXKBD-IEOSBIPESA-N | DNIAPMSPPWPWGF-UHFFFAOYSA-N | Cc1c(C)c2c(c(C)c1O)CC[C@@](C)(CCC[C@H](C)CCC[C@H](C)CCCC(C)C)O2 | CC(O)CO | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rattus norvegicus rats, chronic Al-intoxication model with Vit E coadministration, in vivo basal bile collection, n=6.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile-acid-independent ... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 6.51 | 4.79 | 1.72 | 5.5845 | {
"nontransfer": 0.28494840607207894,
"transfer": 0.7150515939279211
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 1.72 | 0.307995 | 0.715052 | 5.5845 | 0.715052 | 0.284948 | safety_canonical_v27 | 1 | true | 0.106383 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | GVJHHUAWPYXKBD-IEOSBIPESA-N | DNIAPMSPPWPWGF-UHFFFAOYSA-N | c1ccc2c(c1)CCCO2 | parent:DNIAPMSPPWPWGF-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "6.51",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 6.51,
"aggregate_max": 6.51,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.79",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.79,
"aggregate_max": 4.79,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rattus norvegicus rats, chronic Al-intoxication model with Vit E coadministration, in vivo basal bile collection, n=6.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.88,"effect_direction":"increase","endp... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"no_change... | L4 | gold_v1 | sr_d19213833dea4a8880e9dfe814d229ea | sr_b051effdb7c548f7ac1a6aa1a01994a4 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>COc1cc2c(c(OC)c1OC)-c1ccc(OC)c(=O)cc1[C@@H](NC(C)=O)CC2</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rattus norvegicus (rat), intact in vivo system (meta... | (A) | train | 60f495aceb487eb970bb901080a044a34cfb40a4521534fb2eeb5377c44bd7e1 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:daef7ee17eae0383aec6c740eb0c3ca773f85a7d3cd050a9db2bd665421fa71d | dili:92e4e559cb6021ffa17757dbd3d0e5a6057fed83c2a26fdc5930ba6ef0a55876 | dili:daef7ee17eae0383aec6c740eb0c3ca773f85a7d3cd050a9db2bd665421fa71d | dili:92e4e559cb6021ffa17757dbd3d0e5a6057fed83c2a26fdc5930ba6ef0a55876 | OCZNOKJDQKWBTM-UHFFFAOYSA-N | IAKHMKGGTNLKSZ-INIZCTEOSA-N | CC(C)(C)C(C)(C)Cc1ccc(OCCO)c(Cc2cc(CC(C)(C)C(C)(C)C)cc(Cc3cc(CC(C)(C)C(C)(C)C)ccc3OCCO)c2OCCO)c1 | COc1cc2c(c(OC)c1OC)-c1ccc(OC)c(=O)cc1[C@@H](NC(C)=O)CC2 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo rat (Rattus norvegicus) liver; six animals per group; intact in vivo system (intrinsically metabolically competent).",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=basal bile flow rate",
... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rattus norvegicus (rat), intact in vivo system (metabolically competent), colchicine-treated for 8 hr; bile collected and measured.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 7.8 | 7.4 | 0.4 | 5.5845 | {
"nontransfer": 0.03613352183470764,
"transfer": 0.9638664781652924
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 0.4 | 0.071627 | 0.963866 | 5.5845 | 0.963866 | 0.036134 | safety_canonical_v27 | 1 | true | 0.12987 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | OCZNOKJDQKWBTM-UHFFFAOYSA-N | IAKHMKGGTNLKSZ-INIZCTEOSA-N | c1ccc(Cc2cccc(Cc3ccccc3)c2)cc1 | O=c1cccc2c(c1)CCCc1ccccc1-2 | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.8",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.8,
"aggregate_max": 7.8,
"aggregate_q1": ... | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.4",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.4,
"aggregate_max": 7.4,
"aggregate_q1": ... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo rat (Rattus norvegicus) liver; six animals per group; intact in vivo system (intrinsically metabolically competent).","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.8,"effect_direction":"increase",... | {"assay_format":"in_vivo_animal","biological_system_context":"Rattus norvegicus (rat), intact in vivo system (metabolically competent), colchicine-treated for 8 hr; bile collected and measured.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"dec... | L4 | gold_v1 | sr_153eb54cece64d7bbc5ec955a7f8f309 | sr_91bbdf701b3d4cbfa8023dcfc56fb2e7 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rats, in viv... | (A) | train | 0b3d19ffc7010db06b6d211d3273beb901db1cc7e030b2a133aa67ba9e0f0bbd | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:cdc7b538cd367a59ebd7842a083e6e368139d1174b1556a671e84f3136199f86 | dili:23fce8cdc1a3034e8a61beb7be05f27ce53664c8a613c384a1f4826b287a3b1e | dili:cdc7b538cd367a59ebd7842a083e6e368139d1174b1556a671e84f3136199f86 | dili:23fce8cdc1a3034e8a61beb7be05f27ce53664c8a613c384a1f4826b287a3b1e | BHTRKEVKTKCXOH-LBSADWJPSA-N | GHCZAUBVMUEKKP-XROMFQGDSA-N | C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo rat biliary excretion study; species Rattus norvegicus; intact metabolic competence",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate during Tm period",
"endpoint_name=bilia... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rats, in vivo bile-collection experiment",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate at Tm",
"endpoint_name=biliary_secretion_or_bile_flow",
"exposure_conditions=Glycoursode... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 15.9 | 15.45 | 0.45 | 5.5845 | {
"nontransfer": 0.03938463836655581,
"transfer": 0.9606153616334442
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 0.45 | 0.08058 | 0.960615 | 5.5845 | 0.960615 | 0.039385 | safety_canonical_v27 | 1 | true | 0.746032 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | BHTRKEVKTKCXOH-LBSADWJPSA-N | GHCZAUBVMUEKKP-XROMFQGDSA-N | C1CCC2C(C1)CCC1C3CCCC3CCC21 | C1CCC2C(C1)CCC1C3CCCC3CCC21 | {
"aggregation_method": "individual_record",
"display_measurement_text": "15.9",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 15.9,
"aggregate_max": 15.9,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "15.45",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 15.45,
"aggregate_max": 15.45,
"aggregate... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo rat biliary excretion study; species Rattus norvegicus; intact metabolic competence","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"present","endpoint_metric":"bile flow rate ... | {"assay_format":"in_vivo_animal","biological_system_context":"Rats, in vivo bile-collection experiment","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"present","endpoint_metric":"bile flow rate at Tm","endpoint_name":"biliary_secretion_or_bile_... | L4 | gold_v1 | sr_9a6596cb8a914ad4871d994a3d52c1f9 | sr_e6b4d77b904f460995dbf02ba8653c2b | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CCSCC[C@H](N)C(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group
- C... | (A) | train | 3714b705ec1abc9fa1681317e6222a8eccde08688628629e0a2d6d833bc85f97 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:bbe7c9cb57f743e44885a7c45a1fff29fdd54a0470486dac89653fb7d6254e84 | dili:40647c681f6bc3cab99cb8a92b684c56c05243b67622d3ed853b6b394ef58693 | dili:bbe7c9cb57f743e44885a7c45a1fff29fdd54a0470486dac89653fb7d6254e84 | dili:40647c681f6bc3cab99cb8a92b684c56c05243b67622d3ed853b6b394ef58693 | UEEJHVSXFDXPFK-UHFFFAOYSA-N | GGLZPLKKBSSKCX-YFKPBYRVSA-N | CN(C)CCO | CCSCC[C@H](N)C(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Adult male Wistar rats with an external bile fistula and jugular catheter, in vivo; baseline saline infusion to wash out endogenous bile salt pool.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=... | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 2.3 | 4.11 | 1.81 | 9.325017 | {
"nontransfer": 0.11314766464366122,
"transfer": 0.8868523353563388
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 1.81 | 0.194102 | 0.886852 | 9.325017 | 0.886852 | 0.113148 | safety_canonical_v27 | 1 | true | 0.09375 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | UEEJHVSXFDXPFK-UHFFFAOYSA-N | GGLZPLKKBSSKCX-YFKPBYRVSA-N | parent:UEEJHVSXFDXPFK-UHFFFAOYSA-N | parent:GGLZPLKKBSSKCX-YFKPBYRVSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "2.3",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2.3,
"aggregate_max": 2.3,
"aggregate_q1": 2.3,
"aggr... | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.11",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.11,
"aggregate_max": 4.11,
"aggregate_q1": 4.11,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Adult male Wistar rats with an external bile fistula and jugular catheter, in vivo; baseline saline infusion to wash out endogenous bile salt pool.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect... | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"increase","endpoint_metric":"bile flow rate","end... | L4 | gold_v1 | sr_e23e2eaa4b19487281e3ca47eec1d24c | sr_3e35e9025cd54d798701ec3ad7e71a9a | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CCSCC[C@H](N)C(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group
- C... | (B) | train | c4e6f7c677f37e383a4c825846c3287345d2813b5b7dc176dc18e17e48510737 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:79711e38deb67325affb51896f2dc6386c59f0b9d653e2b0daa75e2c463fcbf4 | dili:40647c681f6bc3cab99cb8a92b684c56c05243b67622d3ed853b6b394ef58693 | dili:79711e38deb67325affb51896f2dc6386c59f0b9d653e2b0daa75e2c463fcbf4 | dili:40647c681f6bc3cab99cb8a92b684c56c05243b67622d3ed853b6b394ef58693 | UCMIRNVEIXFBKS-UHFFFAOYSA-N | GGLZPLKKBSSKCX-YFKPBYRVSA-N | NCCC(=O)O | CCSCC[C@H](N)C(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus), in vivo, bile-collection model; β-alanine-pretreated (taurine depletion) rats coinfused TCDC+UDC (group F); intact metabolic competence.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"en... | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 18.27 | 4.11 | 14.16 | 9.325017 | {
"nontransfer": 0.9999861187686012,
"transfer": 0.000013881231398774216
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 14.16 | 1.518496 | 0.000014 | 9.325017 | 0.000014 | 0.999986 | safety_canonical_v27 | 0 | true | 0.2 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | UCMIRNVEIXFBKS-UHFFFAOYSA-N | GGLZPLKKBSSKCX-YFKPBYRVSA-N | parent:UCMIRNVEIXFBKS-UHFFFAOYSA-N | parent:GGLZPLKKBSSKCX-YFKPBYRVSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "18.27",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 18.27,
"aggregate_max": 18.27,
"aggregate_q1": 18.27,... | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.11",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.11,
"aggregate_max": 4.11,
"aggregate_q1": 4.11,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus), in vivo, bile-collection model; \u03b2-alanine-pretreated (taurine depletion) rats coinfused TCDC+UDC (group F); intact metabolic competence.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","conf... | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"increase","endpoint_metric":"bile flow rate","end... | L4 | gold_v1 | sr_c369c3f6667e4396b11581e21f34079e | sr_3e35e9025cd54d798701ec3ad7e71a9a | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: In vivo male... | (B) | train | d41ca399ffeebfa554ba3a52c631944acef5b09d22d1ad8c184863bfb4f1c8fa | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:32e00f1154dbb58ce37df0104fe3b80ee3378363957e182b93c27559330908f4 | dili:585216628833c092b974ed7686b0d83aa37d683d966c2bc8891183857cdba3f3 | dili:32e00f1154dbb58ce37df0104fe3b80ee3378363957e182b93c27559330908f4 | dili:585216628833c092b974ed7686b0d83aa37d683d966c2bc8891183857cdba3f3 | DKPMWHFRUGMUKF-CRKPLTDNSA-N | DKPMWHFRUGMUKF-GDYCBZMLSA-N | C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo bile-collection study; Sprague-Dawley rats (n=3-4 experiments). Intact animal, intrinsically metabolically competent per protocol.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow... | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_me... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 13 | 18.76 | 5.76 | 9.325017 | {
"nontransfer": 0.8981588297381823,
"transfer": 0.10184117026181769
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 5.76 | 0.617693 | 0.101841 | 9.325017 | 0.101841 | 0.898159 | safety_canonical_v27 | 0 | true | 1 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | DKPMWHFRUGMUKF-CRKPLTDNSA-N | DKPMWHFRUGMUKF-GDYCBZMLSA-N | C1CCC2C(C1)CCC1C3CCCC3CCC21 | C1CCC2C(C1)CCC1C3CCCC3CCC21 | {
"aggregation_method": "individual_record",
"display_measurement_text": "13",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 13,
"aggregate_max": 13,
"aggregate_q1": 13,
"aggregat... | {
"aggregation_method": "individual_record",
"display_measurement_text": "18.76",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 18.76,
"aggregate_max": 18.76,
"aggregate_q1": 18.76,... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo bile-collection study; Sprague-Dawley rats (n=3-4 experiments). Intact animal, intrinsically metabolically competent per protocol.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_directio... | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"... | L4 | gold_v1 | sr_94f588ab3baa4327a97d1d188f52e534 | sr_2e7e6b62948e4bee8840080aec5c1f56 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>COC(=O)C1=CO[C@@H](O)[C@@H]2C(CO)=CC[C@H]12</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Sprague-Dawley rats, in vivo bile collection
- Canonical assay c... | (B) | train | 4724bdd5d95e93355cd2491327f5c15da0652d7bacfbef9290dc61f0d0c80aea | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:8130a61e464897b7b951670ffdf271fd0de7852501950e364cec1d6ba39c6910 | dili:a1d3ebcf5f469c0a632cab858b2c72c97e6273d2e9f60c1096da3d9ff4984acb | dili:8130a61e464897b7b951670ffdf271fd0de7852501950e364cec1d6ba39c6910 | dili:a1d3ebcf5f469c0a632cab858b2c72c97e6273d2e9f60c1096da3d9ff4984acb | KPSRODZRAIWAKH-UHFFFAOYSA-N | AZKVWQKMDGGDSV-BCMRRPTOSA-N | CC(C)(Oc1ccc(C2CC2(Cl)Cl)cc1)C(=O)O | COC(=O)C1=CO[C@@H](O)[C@@H]2C(CO)=CC[C@H]12 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Male wild-type mice (Mus musculus); in vivo bile collection; metabolic competence: intact in vivo system; units per 100 g body weight",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate... | [
"assay_format=in_vivo_animal",
"biological_system_context=Sprague-Dawley rats, in vivo bile collection",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flow",
"exposure_conditions=genipin orall... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 30.3 | 7.02 | 23.28 | 9.325017 | {
"nontransfer": 0.9999999992148153,
"transfer": 7.851847318082662e-10
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 23.28 | 2.49651 | 0 | 9.325017 | 0 | 1 | safety_canonical_v27 | 0 | true | 0.145161 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | KPSRODZRAIWAKH-UHFFFAOYSA-N | AZKVWQKMDGGDSV-BCMRRPTOSA-N | c1ccc(C2CC2)cc1 | C1=CC2COC=CC2C1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "30.3",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 30.3,
"aggregate_max": 30.3,
"aggregate_q1": 30.3,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.02",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.02,
"aggregate_max": 7.02,
"aggregate_q1": 7.02,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Male wild-type mice (Mus musculus); in vivo bile collection; metabolic competence: intact in vivo system; units per 100 g body weight","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"i... | {"assay_format":"in_vivo_animal","biological_system_context":"Sprague-Dawley rats, in vivo bile collection","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase","endpoint_metric":"bile flow rate","endpoint_name":"biliary_secretion_or_bile_fl... | L4 | gold_v1 | sr_19655acb45a14205aca1078fbaec5115 | sr_0c9d68f22b534e68a2076c18bcb48111 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>COC(=O)C1=CO[C@@H](O)[C@@H]2C(CO)=CC[C@H]12</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Sprague-Dawley rats, in vivo bile collection
- Canonical assay c... | (B) | train | 3b23ade690efcaa36341e8a2d03363a19d3bf993485969f6e8d3c5040fa0637d | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:cb323b9f1c7dd04805b87ba450736683b22e79809056020d5364181aa974bac0 | dili:a1d3ebcf5f469c0a632cab858b2c72c97e6273d2e9f60c1096da3d9ff4984acb | dili:cb323b9f1c7dd04805b87ba450736683b22e79809056020d5364181aa974bac0 | dili:a1d3ebcf5f469c0a632cab858b2c72c97e6273d2e9f60c1096da3d9ff4984acb | KPSRODZRAIWAKH-UHFFFAOYSA-N | AZKVWQKMDGGDSV-BCMRRPTOSA-N | CC(C)(Oc1ccc(C2CC2(Cl)Cl)cc1)C(=O)O | COC(=O)C1=CO[C@@H](O)[C@@H]2C(CO)=CC[C@H]12 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Wild-type and Pparα(-/-) SV129 mice, in vivo bile collection (n=7-10 per group); intrinsically metabolically competent in vivo system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rat... | [
"assay_format=in_vivo_animal",
"biological_system_context=Sprague-Dawley rats, in vivo bile collection",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flow",
"exposure_conditions=genipin orall... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 30.3 | 7.02 | 23.28 | 9.325017 | {
"nontransfer": 0.9999999992148153,
"transfer": 7.851847318082662e-10
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 23.28 | 2.49651 | 0 | 9.325017 | 0 | 1 | safety_canonical_v27 | 0 | true | 0.145161 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | KPSRODZRAIWAKH-UHFFFAOYSA-N | AZKVWQKMDGGDSV-BCMRRPTOSA-N | c1ccc(C2CC2)cc1 | C1=CC2COC=CC2C1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "30.3",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 30.3,
"aggregate_max": 30.3,
"aggregate_q1": 30.3,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.02",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.02,
"aggregate_max": 7.02,
"aggregate_q1": 7.02,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Wild-type and Ppar\u03b1(-/-) SV129 mice, in vivo bile collection (n=7-10 per group); intrinsically metabolically competent in vivo system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_directi... | {"assay_format":"in_vivo_animal","biological_system_context":"Sprague-Dawley rats, in vivo bile collection","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase","endpoint_metric":"bile flow rate","endpoint_name":"biliary_secretion_or_bile_fl... | L4 | gold_v1 | sr_38ddc4a129ed4f1d9623f10dbfa65e9f | sr_0c9d68f22b534e68a2076c18bcb48111 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: In vivo bil... | (B) | train | e35770de58d7fb34cc6285e7642dc331c01f68ab46d5d5ba986a151cb73d3f5f | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:8594b20023e2972b71590f545290aca80cb67a1a24387f80a4d98de5b6379f74 | dili:32e00f1154dbb58ce37df0104fe3b80ee3378363957e182b93c27559330908f4 | dili:8594b20023e2972b71590f545290aca80cb67a1a24387f80a4d98de5b6379f74 | dili:32e00f1154dbb58ce37df0104fe3b80ee3378363957e182b93c27559330908f4 | YPHMISFOHDHNIV-FSZOTQKASA-N | DKPMWHFRUGMUKF-CRKPLTDNSA-N | C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1 | C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo bile-collection study; Sprague-Dawley rats (n=3-4 experiments). Intact animal, intrinsically metabolically competent per protocol.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 6.8 | 13 | 6.2 | 9.325017 | {
"nontransfer": 0.9339358483609331,
"transfer": 0.06606415163906684
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 6.2 | 0.664878 | 0.066064 | 9.325017 | 0.066064 | 0.933936 | safety_canonical_v27 | 0 | true | 0.15942 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | YPHMISFOHDHNIV-FSZOTQKASA-N | DKPMWHFRUGMUKF-CRKPLTDNSA-N | O=C1CC(CCC2CCCCC2=O)CC(=O)N1 | C1CCC2C(C1)CCC1C3CCCC3CCC21 | {
"aggregation_method": "individual_record",
"display_measurement_text": "6.8",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 6.8,
"aggregate_max": 6.8,
"aggregate_q1": 6.8,
"aggr... | {
"aggregation_method": "individual_record",
"display_measurement_text": "13",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 13,
"aggregate_max": 13,
"aggregate_q1": 13,
"aggregat... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase","endpoint_metric":"bile flow rate","endp... | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo bile-collection study; Sprague-Dawley rats (n=3-4 experiments). Intact animal, intrinsically metabolically competent per protocol.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_directio... | L4 | gold_v1 | sr_8671a76ad38344b594755b5d2d018137 | sr_94f588ab3baa4327a97d1d188f52e534 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Male rats (Rattus norvegicus), in vivo, timed bil... | (A) | train | 4cb7c8b9ed6b3d53ed6b2921839b491de91d95ee88543f1371b15be22b78fd57 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:a1d3ebcf5f469c0a632cab858b2c72c97e6273d2e9f60c1096da3d9ff4984acb | dili:8594b20023e2972b71590f545290aca80cb67a1a24387f80a4d98de5b6379f74 | dili:a1d3ebcf5f469c0a632cab858b2c72c97e6273d2e9f60c1096da3d9ff4984acb | dili:8594b20023e2972b71590f545290aca80cb67a1a24387f80a4d98de5b6379f74 | AZKVWQKMDGGDSV-BCMRRPTOSA-N | YPHMISFOHDHNIV-FSZOTQKASA-N | COC(=O)C1=CO[C@@H](O)[C@@H]2C(CO)=CC[C@H]12 | C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Sprague-Dawley rats, in vivo bile collection",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flow",
"exposure_conditions=genipin orall... | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 7.02 | 6.8 | 0.22 | 9.325017 | {
"nontransfer": 0.022663495967353064,
"transfer": 0.9773365040326469
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 0.22 | 0.023592 | 0.977337 | 9.325017 | 0.977337 | 0.022663 | safety_canonical_v27 | 1 | true | 0.106061 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | AZKVWQKMDGGDSV-BCMRRPTOSA-N | YPHMISFOHDHNIV-FSZOTQKASA-N | C1=CC2COC=CC2C1 | O=C1CC(CCC2CCCCC2=O)CC(=O)N1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.02",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.02,
"aggregate_max": 7.02,
"aggregate_q1": 7.02,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "6.8",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 6.8,
"aggregate_max": 6.8,
"aggregate_q1": 6.8,
"aggr... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Sprague-Dawley rats, in vivo bile collection","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase","endpoint_metric":"bile flow rate","endpoint_name":"biliary_secretion_or_bile_fl... | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase","endpoint_metric":"bile flow rate","endp... | L4 | gold_v1 | sr_0c9d68f22b534e68a2076c18bcb48111 | sr_8671a76ad38344b594755b5d2d018137 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus) in viv... | (B) | train | a441c9f57cafa5c74379007ad954f4d08c58f90ed9cc8a2da7cf9ddfe4872ee0 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:9dee46f49be1a7877c963e10dba295f26374aca2325f2e47d0dd418452eb56b3 | dili:182e1713eb9965d45677af92b3e9f1e05f2bd9cce55eea95950a5c4623b57081 | dili:9dee46f49be1a7877c963e10dba295f26374aca2325f2e47d0dd418452eb56b3 | dili:182e1713eb9965d45677af92b3e9f1e05f2bd9cce55eea95950a5c4623b57081 | ITRJWOMZKQRYTA-RFZYENFJSA-N | MECYMOKOKLARJV-PCNQZJBLSA-N | CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3C(=O)C[C@@]21C | C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile-acid-independent ... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 4.43 | 0.27 | 4.16 | 5.5845 | {
"nontransfer": 0.96920696653719,
"transfer": 0.03079303346281004
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 4.16 | 0.744919 | 0.030793 | 5.5845 | 0.030793 | 0.969207 | safety_canonical_v27 | 0 | true | 0.195876 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ITRJWOMZKQRYTA-RFZYENFJSA-N | MECYMOKOKLARJV-PCNQZJBLSA-N | O=C1C=C2CCC3C4CCCC4CC(=O)C3C2CC1 | C1=C2CCCCC2C2CCC3CCCC3C2C1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.43",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.43,
"aggregate_max": 4.43,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "0.27",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 0.27,
"aggregate_max": 0.27,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"no_change... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"decrea... | L4 | gold_v1 | sr_52188b0589eb43ada64e7fab1b5bd593 | sr_5916d18874cd46a487a6aef7541223af | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat in vivo; bile collection with maximal bile-ac... | (B) | train | d66f5d448874694ab2f460d6abed2aa403b910ec3df46d6a0c76512387e5db48 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:585216628833c092b974ed7686b0d83aa37d683d966c2bc8891183857cdba3f3 | dili:21c4e80fadd27673efd0e708e1809b2464e24a8e6dafceba42d0fd9f9e9e9717 | dili:585216628833c092b974ed7686b0d83aa37d683d966c2bc8891183857cdba3f3 | dili:21c4e80fadd27673efd0e708e1809b2464e24a8e6dafceba42d0fd9f9e9e9717 | DKPMWHFRUGMUKF-GDYCBZMLSA-N | YPHMISFOHDHNIV-FSZOTQKASA-N | C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_me... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat in vivo; bile collection with maximal bile-acid stimulation, 16 h after cycloheximide",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=maximal bile flow",
"endpoint_name=biliary_secretion_or_... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 18.76 | 10.6 | 8.16 | 9.325017 | {
"nontransfer": 0.991428077277803,
"transfer": 0.008571922722196968
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 8.16 | 0.875065 | 0.008572 | 9.325017 | 0.008572 | 0.991428 | safety_canonical_v27 | 0 | true | 0.15942 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | DKPMWHFRUGMUKF-GDYCBZMLSA-N | YPHMISFOHDHNIV-FSZOTQKASA-N | C1CCC2C(C1)CCC1C3CCCC3CCC21 | O=C1CC(CCC2CCCCC2=O)CC(=O)N1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "18.76",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 18.76,
"aggregate_max": 18.76,
"aggregate_q1": 18.76,... | {
"aggregation_method": "individual_record",
"display_measurement_text": "10.6",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 10.6,
"aggregate_max": 10.6,
"aggregate_q1": 10.6,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat in vivo; bile collection with maximal bile-acid stimulation, 16 h after cycloheximide","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"decrease","endpoint_metric":"maximal bile fl... | L4 | gold_v1 | sr_2e7e6b62948e4bee8840080aec5c1f56 | sr_87527682a95540b7ab2d5d24cc3ade6e | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Male rats (Rattus norvegicus), in vivo, timed bil... | (A) | train | b6295b3fedc177988d1c69bb333607f0009d2361aa67aed9174b10039ceab680 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:530894f53b6346e450e3f5214ee1f0722c91914516a7f04b74de05630d295473 | dili:32689c2b57e4228d1a9519ea72deb8452513798897810c8dd6f15cfefe32a277 | dili:530894f53b6346e450e3f5214ee1f0722c91914516a7f04b74de05630d295473 | dili:32689c2b57e4228d1a9519ea72deb8452513798897810c8dd6f15cfefe32a277 | WEXRUCMBJFQVBZ-UHFFFAOYSA-N | YPHMISFOHDHNIV-FSZOTQKASA-N | CCCC(C)C1(CC)C(=O)NC(=O)NC1=O | C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo rats (Rattus norvegicus) with eight days biliary drainage (BD group); metabolically competent intact in vivo system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile acid-independent f... | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 2.38 | 4.06 | 1.68 | 9.325017 | {
"nontransfer": 0.09989473878250343,
"transfer": 0.9001052612174966
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 1.68 | 0.180161 | 0.900105 | 9.325017 | 0.900105 | 0.099895 | safety_canonical_v27 | 1 | true | 0.153846 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | WEXRUCMBJFQVBZ-UHFFFAOYSA-N | YPHMISFOHDHNIV-FSZOTQKASA-N | O=C1CC(=O)NC(=O)N1 | O=C1CC(CCC2CCCCC2=O)CC(=O)N1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "2.38",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2.38,
"aggregate_max": 2.38,
"aggregate_q1": 2.38,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.06",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.06,
"aggregate_max": 4.06,
"aggregate_q1": 4.06,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo rats (Rattus norvegicus) with eight days biliary drainage (BD group); metabolically competent intact in vivo system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.8,"effect_direction":"increase",... | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase","endpoint_metric":"bile flow rate","endp... | L4 | gold_v1 | sr_fe6b04f2fd644b86b6c89167ebb035a1 | sr_d2a6f3c9e2c444fd94496ea3fdd30f9e | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: In vivo mal... | (B) | train | 03c7538dd5fc17ea20a792f45c9c5f12f59fe8b228ad99e9d388f9795c808339 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:21c4e80fadd27673efd0e708e1809b2464e24a8e6dafceba42d0fd9f9e9e9717 | dili:ae3f62ea784940a5875c7864839486fee1f002880101a68f8ab7cefa8e9e86a6 | dili:21c4e80fadd27673efd0e708e1809b2464e24a8e6dafceba42d0fd9f9e9e9717 | dili:ae3f62ea784940a5875c7864839486fee1f002880101a68f8ab7cefa8e9e86a6 | YPHMISFOHDHNIV-FSZOTQKASA-N | DKPMWHFRUGMUKF-CRKPLTDNSA-N | C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1 | C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat in vivo; bile collection with maximal bile-acid stimulation, 16 h after cycloheximide",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=maximal bile flow",
"endpoint_name=biliary_secretion_or_... | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_me... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 10.6 | 18.85 | 8.25 | 9.325017 | {
"nontransfer": 0.9922105796387564,
"transfer": 0.007789420361243601
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 8.25 | 0.884717 | 0.007789 | 9.325017 | 0.007789 | 0.992211 | safety_canonical_v27 | 0 | true | 0.15942 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | YPHMISFOHDHNIV-FSZOTQKASA-N | DKPMWHFRUGMUKF-CRKPLTDNSA-N | O=C1CC(CCC2CCCCC2=O)CC(=O)N1 | C1CCC2C(C1)CCC1C3CCCC3CCC21 | {
"aggregation_method": "individual_record",
"display_measurement_text": "10.6",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 10.6,
"aggregate_max": 10.6,
"aggregate_q1": 10.6,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "18.85",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 18.85,
"aggregate_max": 18.85,
"aggregate_q1": 18.85,... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat in vivo; bile collection with maximal bile-acid stimulation, 16 h after cycloheximide","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"decrease","endpoint_metric":"maximal bile fl... | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"... | L4 | gold_v1 | sr_87527682a95540b7ab2d5d24cc3ade6e | sr_e0dd87d38fae4210ae54dbe4c0107f6b | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3C(=O)C[C@@]21C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus) in vi... | (B) | train | 68d932acf86b4f089ce28daaa08342a9dd6525a1f59d11fda85d587439f5a685 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:92e4e559cb6021ffa17757dbd3d0e5a6057fed83c2a26fdc5930ba6ef0a55876 | dili:9dee46f49be1a7877c963e10dba295f26374aca2325f2e47d0dd418452eb56b3 | dili:92e4e559cb6021ffa17757dbd3d0e5a6057fed83c2a26fdc5930ba6ef0a55876 | dili:9dee46f49be1a7877c963e10dba295f26374aca2325f2e47d0dd418452eb56b3 | IAKHMKGGTNLKSZ-INIZCTEOSA-N | ITRJWOMZKQRYTA-RFZYENFJSA-N | COc1cc2c(c(OC)c1OC)-c1ccc(OC)c(=O)cc1[C@@H](NC(C)=O)CC2 | CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3C(=O)C[C@@]21C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rattus norvegicus (rat), intact in vivo system (metabolically competent), colchicine-treated for 8 hr; bile collected and measured.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile-acid-independent ... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 7.4 | 4.43 | 2.97 | 5.5845 | {
"nontransfer": 0.7888973468392615,
"transfer": 0.21110265316073848
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 2.97 | 0.531829 | 0.211103 | 5.5845 | 0.211103 | 0.788897 | safety_canonical_v27 | 0 | true | 0.159091 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | IAKHMKGGTNLKSZ-INIZCTEOSA-N | ITRJWOMZKQRYTA-RFZYENFJSA-N | O=c1cccc2c(c1)CCCc1ccccc1-2 | O=C1C=C2CCC3C4CCCC4CC(=O)C3C2CC1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.4",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.4,
"aggregate_max": 7.4,
"aggregate_q1": ... | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.43",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.43,
"aggregate_max": 4.43,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rattus norvegicus (rat), intact in vivo system (metabolically competent), colchicine-treated for 8 hr; bile collected and measured.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"dec... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"no_change... | L4 | gold_v1 | sr_91bbdf701b3d4cbfa8023dcfc56fb2e7 | sr_52188b0589eb43ada64e7fab1b5bd593 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>NCCC(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus), in vivo, bile-collection model; β-alanine-pretreated (taurine depletion) ... | (A) | train | 3e0be2299dacc7ee09e095dfefe2f90b3eae9fdc76b554d5d16e0638409b6296 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:e95335d99af822c5d343f9a88c23c529c7627dca123ac0d13f0da13743177049 | dili:79711e38deb67325affb51896f2dc6386c59f0b9d653e2b0daa75e2c463fcbf4 | dili:e95335d99af822c5d343f9a88c23c529c7627dca123ac0d13f0da13743177049 | dili:79711e38deb67325affb51896f2dc6386c59f0b9d653e2b0daa75e2c463fcbf4 | VFNGKCDDZUSWLR-UHFFFAOYSA-N | UCMIRNVEIXFBKS-UHFFFAOYSA-N | O=S(=O)(O)OS(=O)(=O)O | NCCC(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo bile-collection study; Sprague-Dawley rats (n=3-4 experiments). Intact animal, intrinsically metabolically competent per protocol.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus), in vivo, bile-collection model; β-alanine-pretreated (taurine depletion) rats coinfused TCDC+UDC (group F); intact metabolic competence.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"en... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 14.9 | 18.27 | 3.37 | 9.325017 | {
"nontransfer": 0.40466479791533916,
"transfer": 0.5953352020846608
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 3.37 | 0.361393 | 0.595335 | 9.325017 | 0.595335 | 0.404665 | safety_canonical_v27 | 1 | false | 0.095238 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | VFNGKCDDZUSWLR-UHFFFAOYSA-N | UCMIRNVEIXFBKS-UHFFFAOYSA-N | parent:VFNGKCDDZUSWLR-UHFFFAOYSA-N | parent:UCMIRNVEIXFBKS-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "14.9",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 14.9,
"aggregate_max": 14.9,
"aggregate_q1": 14.9,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "18.27",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 18.27,
"aggregate_max": 18.27,
"aggregate_q1": 18.27,... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo bile-collection study; Sprague-Dawley rats (n=3-4 experiments). Intact animal, intrinsically metabolically competent per protocol.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_directio... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus), in vivo, bile-collection model; \u03b2-alanine-pretreated (taurine depletion) rats coinfused TCDC+UDC (group F); intact metabolic competence.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","conf... | L4 | gold_v1 | sr_654bdd09cb604a5fb88584a399179675 | sr_c369c3f6667e4396b11581e21f34079e | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CCCC(C)C1(CC)C(=O)NC(=O)NC1=O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: In vivo rats (Rattus norvegicus) with eight days biliary drainage (BD group); ... | (A) | train | bd473665b57b0c2cc90927844c95bb667c4ef37f865278dd52b55d5aeeb25c06 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:28e81598a8658dbfe44abd0947b0be027f1e3ca32001c70ed954b8522ee722ea | dili:530894f53b6346e450e3f5214ee1f0722c91914516a7f04b74de05630d295473 | dili:28e81598a8658dbfe44abd0947b0be027f1e3ca32001c70ed954b8522ee722ea | dili:530894f53b6346e450e3f5214ee1f0722c91914516a7f04b74de05630d295473 | YPHMISFOHDHNIV-FSZOTQKASA-N | WEXRUCMBJFQVBZ-UHFFFAOYSA-N | C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1 | CCCC(C)C1(CC)C(=O)NC(=O)NC1=O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo rats (Rattus norvegicus) with eight days biliary drainage (BD group); metabolically competent intact in vivo system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile acid-independent f... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 5.38 | 2.38 | 3 | 9.325017 | {
"nontransfer": 0.3137064732133059,
"transfer": 0.6862935267866941
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 3 | 0.321715 | 0.686294 | 9.325017 | 0.686294 | 0.313706 | safety_canonical_v27 | 1 | true | 0.153846 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | YPHMISFOHDHNIV-FSZOTQKASA-N | WEXRUCMBJFQVBZ-UHFFFAOYSA-N | O=C1CC(CCC2CCCCC2=O)CC(=O)N1 | O=C1CC(=O)NC(=O)N1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "5.38",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 5.38,
"aggregate_max": 5.38,
"aggregate_q1": 5.38,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "2.38",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2.38,
"aggregate_max": 2.38,
"aggregate_q1": 2.38,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"increase","endpoint_metric":"bile flow rate","end... | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo rats (Rattus norvegicus) with eight days biliary drainage (BD group); metabolically competent intact in vivo system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.8,"effect_direction":"increase",... | L4 | gold_v1 | sr_8a4af9c65db445db8f03d24a765dbc72 | sr_fe6b04f2fd644b86b6c89167ebb035a1 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: In vivo... | (A) | train | f08a76a93a1bcc4f4b4af48dc3287448ea046ca4e9e8f88f806036ce6843a8ad | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:23fce8cdc1a3034e8a61beb7be05f27ce53664c8a613c384a1f4826b287a3b1e | dili:cdc7b538cd367a59ebd7842a083e6e368139d1174b1556a671e84f3136199f86 | dili:23fce8cdc1a3034e8a61beb7be05f27ce53664c8a613c384a1f4826b287a3b1e | dili:cdc7b538cd367a59ebd7842a083e6e368139d1174b1556a671e84f3136199f86 | GHCZAUBVMUEKKP-XROMFQGDSA-N | BHTRKEVKTKCXOH-LBSADWJPSA-N | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rats, in vivo bile-collection experiment",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate at Tm",
"endpoint_name=biliary_secretion_or_bile_flow",
"exposure_conditions=Glycoursode... | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo rat biliary excretion study; species Rattus norvegicus; intact metabolic competence",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate during Tm period",
"endpoint_name=bilia... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 15.45 | 15.9 | 0.45 | 5.5845 | {
"nontransfer": 0.03938463836655581,
"transfer": 0.9606153616334442
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 0.45 | 0.08058 | 0.960615 | 5.5845 | 0.960615 | 0.039385 | safety_canonical_v27 | 1 | true | 0.746032 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | GHCZAUBVMUEKKP-XROMFQGDSA-N | BHTRKEVKTKCXOH-LBSADWJPSA-N | C1CCC2C(C1)CCC1C3CCCC3CCC21 | C1CCC2C(C1)CCC1C3CCCC3CCC21 | {
"aggregation_method": "individual_record",
"display_measurement_text": "15.45",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 15.45,
"aggregate_max": 15.45,
"aggregate... | {
"aggregation_method": "individual_record",
"display_measurement_text": "15.9",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 15.9,
"aggregate_max": 15.9,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rats, in vivo bile-collection experiment","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"present","endpoint_metric":"bile flow rate at Tm","endpoint_name":"biliary_secretion_or_bile_... | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo rat biliary excretion study; species Rattus norvegicus; intact metabolic competence","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"present","endpoint_metric":"bile flow rate ... | L4 | gold_v1 | sr_e6b4d77b904f460995dbf02ba8653c2b | sr_9a6596cb8a914ad4871d994a3d52c1f9 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus) in viv... | (A) | train | 26d90bacaa7437ec339f51fe7ee93161e5eacfc03947a7824fc87fcf971c56e4 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:6323cf83ec5257a8d7a665b401a4d2b0196c3c6a4cd48ff522e6c5d597c4a644 | dili:182e1713eb9965d45677af92b3e9f1e05f2bd9cce55eea95950a5c4623b57081 | dili:6323cf83ec5257a8d7a665b401a4d2b0196c3c6a4cd48ff522e6c5d597c4a644 | dili:182e1713eb9965d45677af92b3e9f1e05f2bd9cce55eea95950a5c4623b57081 | MUBZPKHOEPUJKR-UHFFFAOYSA-N | MECYMOKOKLARJV-PCNQZJBLSA-N | O=C(O)C(=O)O | C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 1.87 | 0.27 | 1.6 | 5.5845 | {
"nontransfer": 0.24325297986847938,
"transfer": 0.7567470201315206
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 1.6 | 0.286507 | 0.756747 | 5.5845 | 0.756747 | 0.243253 | safety_canonical_v27 | 1 | true | 0.046154 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | MUBZPKHOEPUJKR-UHFFFAOYSA-N | MECYMOKOKLARJV-PCNQZJBLSA-N | parent:MUBZPKHOEPUJKR-UHFFFAOYSA-N | C1=C2CCCCC2C2CCC3CCCC3C2C1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "1.87",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 1.87,
"aggregate_max": 1.87,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "0.27",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 0.27,
"aggregate_max": 0.27,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"decrea... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"decrea... | L4 | gold_v1 | sr_d600728bdfb849beb6d6bda1d35afcf8 | sr_5916d18874cd46a487a6aef7541223af | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: In vivo male... | (A) | train | 06f11f6fc5d626f5d54c1faf1b9b1b5244fc6667c02041d6959d65b9a595a26d | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:ae3f62ea784940a5875c7864839486fee1f002880101a68f8ab7cefa8e9e86a6 | dili:585216628833c092b974ed7686b0d83aa37d683d966c2bc8891183857cdba3f3 | dili:ae3f62ea784940a5875c7864839486fee1f002880101a68f8ab7cefa8e9e86a6 | dili:585216628833c092b974ed7686b0d83aa37d683d966c2bc8891183857cdba3f3 | DKPMWHFRUGMUKF-CRKPLTDNSA-N | DKPMWHFRUGMUKF-GDYCBZMLSA-N | C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_me... | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_me... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 18.85 | 18.76 | 0.09 | 9.325017 | {
"nontransfer": 0.01977263904633142,
"transfer": 0.9802273609536686
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 0.09 | 0.009651 | 0.980227 | 9.325017 | 0.980227 | 0.019773 | safety_canonical_v27 | 1 | true | 1 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | DKPMWHFRUGMUKF-CRKPLTDNSA-N | DKPMWHFRUGMUKF-GDYCBZMLSA-N | C1CCC2C(C1)CCC1C3CCCC3CCC21 | C1CCC2C(C1)CCC1C3CCCC3CCC21 | {
"aggregation_method": "individual_record",
"display_measurement_text": "18.85",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 18.85,
"aggregate_max": 18.85,
"aggregate_q1": 18.85,... | {
"aggregation_method": "individual_record",
"display_measurement_text": "18.76",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 18.76,
"aggregate_max": 18.76,
"aggregate_q1": 18.76,... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"... | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"... | L4 | gold_v1 | sr_e0dd87d38fae4210ae54dbe4c0107f6b | sr_2e7e6b62948e4bee8840080aec5c1f56 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>NCCC(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rattus norvegicus, in vivo bile collection, bile-salt-free isotope studies, β-alanine pretreated r... | (B) | train | cc0ae1cab60abe4e66cecb47b1f49680d8002bada8a74bf0a6c3a9f2fa1edba2 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:51532c46b483b0f9a8d73b49375551eea075129f5de34ea06c719c95ac522f90 | dili:5efdf6a9f460b4828ceaf1c93eb1b3a761f982e94766e34784424d001483ec37 | dili:51532c46b483b0f9a8d73b49375551eea075129f5de34ea06c719c95ac522f90 | dili:5efdf6a9f460b4828ceaf1c93eb1b3a761f982e94766e34784424d001483ec37 | SGIWFELWJPNFDH-UHFFFAOYSA-N | UCMIRNVEIXFBKS-UHFFFAOYSA-N | O=S(=O)(c1ccccc1)N(CC(F)(F)F)c1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1 | NCCC(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Male C57BL/6J mice, 2-3 months old, in vivo; metabolic competence: intact in vivo (intrinsically competent)",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliar... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rattus norvegicus, in vivo bile collection, bile-salt-free isotope studies, β-alanine pretreated rats versus control rats",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoi... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 7.8 | 21.95 | 14.15 | 5.5845 | {
"nontransfer": 0.9999999994592094,
"transfer": 5.407905855173395e-10
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 14.15 | 2.533799 | 0 | 5.5845 | 0 | 1 | safety_canonical_v27 | 0 | true | 0.111111 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | SGIWFELWJPNFDH-UHFFFAOYSA-N | UCMIRNVEIXFBKS-UHFFFAOYSA-N | O=S(=O)(Nc1ccccc1)c1ccccc1 | parent:UCMIRNVEIXFBKS-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.8",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.8,
"aggregate_max": 7.8,
"aggregate_q1": ... | {
"aggregation_method": "individual_record",
"display_measurement_text": "21.95",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 21.95,
"aggregate_max": 21.95,
"aggregate... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Male C57BL/6J mice, 2-3 months old, in vivo; metabolic competence: intact in vivo (intrinsically competent)","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"no_change","endpoint_metric... | {"assay_format":"in_vivo_animal","biological_system_context":"Rattus norvegicus, in vivo bile collection, bile-salt-free isotope studies, \u03b2-alanine pretreated rats versus control rats","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.8,"effect_direction":"increase... | L4 | gold_v1 | sr_6140b053a4284068ba3638c97504989b | sr_a1ac8787621642a595cf64eb57aa3bf9 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CCCC(C)C1(CC)C(=O)NC(=O)NC1=O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: In vivo rats (Rattus norvegicus) with eight days biliary drainage (BD group); ... | (A) | train | f94ab743947749a5e2344c0b2e4bc6484feed002ae83eeca46c2739047c1b757 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:40647c681f6bc3cab99cb8a92b684c56c05243b67622d3ed853b6b394ef58693 | dili:530894f53b6346e450e3f5214ee1f0722c91914516a7f04b74de05630d295473 | dili:40647c681f6bc3cab99cb8a92b684c56c05243b67622d3ed853b6b394ef58693 | dili:530894f53b6346e450e3f5214ee1f0722c91914516a7f04b74de05630d295473 | GGLZPLKKBSSKCX-YFKPBYRVSA-N | WEXRUCMBJFQVBZ-UHFFFAOYSA-N | CCSCC[C@H](N)C(=O)O | CCCC(C)C1(CC)C(=O)NC(=O)NC1=O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo rats (Rattus norvegicus) with eight days biliary drainage (BD group); metabolically competent intact in vivo system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile acid-independent f... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 4.11 | 2.38 | 1.73 | 9.325017 | {
"nontransfer": 0.1048204441646895,
"transfer": 0.8951795558353105
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 1.73 | 0.185522 | 0.89518 | 9.325017 | 0.89518 | 0.10482 | safety_canonical_v27 | 1 | true | 0.142857 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | GGLZPLKKBSSKCX-YFKPBYRVSA-N | WEXRUCMBJFQVBZ-UHFFFAOYSA-N | parent:GGLZPLKKBSSKCX-YFKPBYRVSA-N | O=C1CC(=O)NC(=O)N1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.11",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.11,
"aggregate_max": 4.11,
"aggregate_q1": 4.11,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "2.38",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2.38,
"aggregate_max": 2.38,
"aggregate_q1": 2.38,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"increase","endpoint_metric":"bile flow rate","end... | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo rats (Rattus norvegicus) with eight days biliary drainage (BD group); metabolically competent intact in vivo system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.8,"effect_direction":"increase",... | L4 | gold_v1 | sr_3e35e9025cd54d798701ec3ad7e71a9a | sr_fe6b04f2fd644b86b6c89167ebb035a1 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: In vivo... | (B) | train | 7b0c10dd99ff4e80d78f2efe97047a9c92c1d8fcaef6d76de083425acfe89e52 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:182e1713eb9965d45677af92b3e9f1e05f2bd9cce55eea95950a5c4623b57081 | dili:cdc7b538cd367a59ebd7842a083e6e368139d1174b1556a671e84f3136199f86 | dili:182e1713eb9965d45677af92b3e9f1e05f2bd9cce55eea95950a5c4623b57081 | dili:cdc7b538cd367a59ebd7842a083e6e368139d1174b1556a671e84f3136199f86 | MECYMOKOKLARJV-PCNQZJBLSA-N | BHTRKEVKTKCXOH-LBSADWJPSA-N | C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C | C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
... | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo rat biliary excretion study; species Rattus norvegicus; intact metabolic competence",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate during Tm period",
"endpoint_name=bilia... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 0.27 | 15.9 | 15.63 | 5.5845 | {
"nontransfer": 0.9999999999617999,
"transfer": 3.8200157081136816e-11
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 15.63 | 2.798818 | 0 | 5.5845 | 0 | 1 | safety_canonical_v27 | 0 | true | 0.608108 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | MECYMOKOKLARJV-PCNQZJBLSA-N | BHTRKEVKTKCXOH-LBSADWJPSA-N | C1=C2CCCCC2C2CCC3CCCC3C2C1 | C1CCC2C(C1)CCC1C3CCCC3CCC21 | {
"aggregation_method": "individual_record",
"display_measurement_text": "0.27",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 0.27,
"aggregate_max": 0.27,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "15.9",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 15.9,
"aggregate_max": 15.9,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"decrea... | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo rat biliary excretion study; species Rattus norvegicus; intact metabolic competence","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"present","endpoint_metric":"bile flow rate ... | L4 | gold_v1 | sr_5916d18874cd46a487a6aef7541223af | sr_9a6596cb8a914ad4871d994a3d52c1f9 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rats, in viv... | (A) | train | b7e1c11867290eaf851b43eafdab64bd460377cb7f27804f2764e968030cc4a1 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:195ed61e8d1b0d5d2fb70b4161c368883e749a947146c6b81a4a5bc207d81eb0 | dili:23fce8cdc1a3034e8a61beb7be05f27ce53664c8a613c384a1f4826b287a3b1e | dili:195ed61e8d1b0d5d2fb70b4161c368883e749a947146c6b81a4a5bc207d81eb0 | dili:23fce8cdc1a3034e8a61beb7be05f27ce53664c8a613c384a1f4826b287a3b1e | DDBREPKUVSBGFI-UHFFFAOYSA-N | GHCZAUBVMUEKKP-XROMFQGDSA-N | CCC1(c2ccccc2)C(=O)NC(=O)NC1=O | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo; individual animals (n up to 10) with bile collected after phenobarbital treatment; values are mean ± SEM.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rats, in vivo bile-collection experiment",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate at Tm",
"endpoint_name=biliary_secretion_or_bile_flow",
"exposure_conditions=Glycoursode... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 13.8 | 15.45 | 1.65 | 5.5845 | {
"nontransfer": 0.260110654169072,
"transfer": 0.739889345830928
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 1.65 | 0.295461 | 0.739889 | 5.5845 | 0.739889 | 0.260111 | safety_canonical_v27 | 1 | true | 0.068493 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | DDBREPKUVSBGFI-UHFFFAOYSA-N | GHCZAUBVMUEKKP-XROMFQGDSA-N | O=C1NC(=O)C(c2ccccc2)C(=O)N1 | C1CCC2C(C1)CCC1C3CCCC3CCC21 | {
"aggregation_method": "individual_record",
"display_measurement_text": "13.8",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 13.8,
"aggregate_max": 13.8,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "15.45",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 15.45,
"aggregate_max": 15.45,
"aggregate... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo; individual animals (n up to 10) with bile collected after phenobarbital treatment; values are mean \u00b1 SEM.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_dir... | {"assay_format":"in_vivo_animal","biological_system_context":"Rats, in vivo bile-collection experiment","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"present","endpoint_metric":"bile flow rate at Tm","endpoint_name":"biliary_secretion_or_bile_... | L4 | gold_v1 | sr_3c302991f01a4f06aa29a4a28d2a5407 | sr_e6b4d77b904f460995dbf02ba8653c2b | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>NCCC(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rattus norvegicus, in vivo bile collection, bile-salt-free isotope studies, β-alanine pretreated r... | (B) | train | b47dd8545c2e6edde96596fec3d5dc86cba4c5ea8d6bba715df0cf5e47599c94 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:e95b60eec6736d3b87d0d1a110d065283935c315862ab97eab1215d5ccceb86f | dili:5efdf6a9f460b4828ceaf1c93eb1b3a761f982e94766e34784424d001483ec37 | dili:e95b60eec6736d3b87d0d1a110d065283935c315862ab97eab1215d5ccceb86f | dili:5efdf6a9f460b4828ceaf1c93eb1b3a761f982e94766e34784424d001483ec37 | XOAAWQZATWQOTB-UHFFFAOYSA-N | UCMIRNVEIXFBKS-UHFFFAOYSA-N | NCCS(=O)(=O)O | NCCC(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=APAP-treated hamsters (Mesocricetus auratus), in vivo, three to six animals per group; intact in vivo system, intrinsically metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rattus norvegicus, in vivo bile collection, bile-salt-free isotope studies, β-alanine pretreated rats versus control rats",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoi... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 7.72 | 21.95 | 14.23 | 5.5845 | {
"nontransfer": 0.9999999995313864,
"transfer": 4.686135624580185e-10
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 14.23 | 2.548124 | 0 | 5.5845 | 0 | 1 | safety_canonical_v27 | 0 | true | 0.285714 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | XOAAWQZATWQOTB-UHFFFAOYSA-N | UCMIRNVEIXFBKS-UHFFFAOYSA-N | parent:XOAAWQZATWQOTB-UHFFFAOYSA-N | parent:UCMIRNVEIXFBKS-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.72",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.72,
"aggregate_max": 7.72,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "21.95",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 21.95,
"aggregate_max": 21.95,
"aggregate... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"APAP-treated hamsters (Mesocricetus auratus), in vivo, three to six animals per group; intact in vivo system, intrinsically metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.75,"effe... | {"assay_format":"in_vivo_animal","biological_system_context":"Rattus norvegicus, in vivo bile collection, bile-salt-free isotope studies, \u03b2-alanine pretreated rats versus control rats","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.8,"effect_direction":"increase... | L4 | gold_v1 | sr_dd3de8c090584b9d9289080b8289b1a5 | sr_a1ac8787621642a595cf64eb57aa3bf9 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>Cc1c(C)c2c(c(C)c1O)CC[C@@](C)(CCC[C@H](C)CCC[C@H](C)CCCC(C)C)O2</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rattus norvegicus rats, chronic Al-intoxicat... | (A) | train | 3a7b335835a17dda2b854bf583a4b8023f156f104d20916bcb688a2dbb82fc5a | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:642f46db98fcfefd64b860bfa2d29ab4e81b49349142e96c276dc0184d6017ef | dili:9efa179c73816a18f1a7e820124cab39565b7cf7e91fee502d68e5fed1f83075 | dili:642f46db98fcfefd64b860bfa2d29ab4e81b49349142e96c276dc0184d6017ef | dili:9efa179c73816a18f1a7e820124cab39565b7cf7e91fee502d68e5fed1f83075 | DNIAPMSPPWPWGF-UHFFFAOYSA-N | GVJHHUAWPYXKBD-IEOSBIPESA-N | CC(O)CO | Cc1c(C)c2c(c(C)c1O)CC[C@@](C)(CCC[C@H](C)CCC[C@H](C)CCCC(C)C)O2 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile-acid-independent ... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rattus norvegicus rats, chronic Al-intoxication model with Vit E coadministration, in vivo basal bile collection, n=6.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 4.79 | 6.51 | 1.72 | 5.5845 | {
"nontransfer": 0.28494840607207894,
"transfer": 0.7150515939279211
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 1.72 | 0.307995 | 0.715052 | 5.5845 | 0.715052 | 0.284948 | safety_canonical_v27 | 1 | true | 0.106383 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | DNIAPMSPPWPWGF-UHFFFAOYSA-N | GVJHHUAWPYXKBD-IEOSBIPESA-N | parent:DNIAPMSPPWPWGF-UHFFFAOYSA-N | c1ccc2c(c1)CCCO2 | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.79",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.79,
"aggregate_max": 4.79,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "6.51",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 6.51,
"aggregate_max": 6.51,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"no_change... | {"assay_format":"in_vivo_animal","biological_system_context":"Rattus norvegicus rats, chronic Al-intoxication model with Vit E coadministration, in vivo basal bile collection, n=6.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.88,"effect_direction":"increase","endp... | L4 | gold_v1 | sr_b051effdb7c548f7ac1a6aa1a01994a4 | sr_d19213833dea4a8880e9dfe814d229ea | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CCCC(C)C1(CC)C(=O)NC(=O)NC1=O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: In vivo rats (Rattus norvegicus) with eight days biliary drainage (BD group); ... | (A) | train | aa35c52c554589003cab3aed119cd5f596fcb8838d88e68e410cd9b0653c1674 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:32689c2b57e4228d1a9519ea72deb8452513798897810c8dd6f15cfefe32a277 | dili:530894f53b6346e450e3f5214ee1f0722c91914516a7f04b74de05630d295473 | dili:32689c2b57e4228d1a9519ea72deb8452513798897810c8dd6f15cfefe32a277 | dili:530894f53b6346e450e3f5214ee1f0722c91914516a7f04b74de05630d295473 | YPHMISFOHDHNIV-FSZOTQKASA-N | WEXRUCMBJFQVBZ-UHFFFAOYSA-N | C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1 | CCCC(C)C1(CC)C(=O)NC(=O)NC1=O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo rats (Rattus norvegicus) with eight days biliary drainage (BD group); metabolically competent intact in vivo system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile acid-independent f... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 4.06 | 2.38 | 1.68 | 9.325017 | {
"nontransfer": 0.09989473878250343,
"transfer": 0.9001052612174966
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 1.68 | 0.180161 | 0.900105 | 9.325017 | 0.900105 | 0.099895 | safety_canonical_v27 | 1 | true | 0.153846 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | YPHMISFOHDHNIV-FSZOTQKASA-N | WEXRUCMBJFQVBZ-UHFFFAOYSA-N | O=C1CC(CCC2CCCCC2=O)CC(=O)N1 | O=C1CC(=O)NC(=O)N1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.06",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.06,
"aggregate_max": 4.06,
"aggregate_q1": 4.06,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "2.38",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2.38,
"aggregate_max": 2.38,
"aggregate_q1": 2.38,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase","endpoint_metric":"bile flow rate","endp... | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo rats (Rattus norvegicus) with eight days biliary drainage (BD group); metabolically competent intact in vivo system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.8,"effect_direction":"increase",... | L4 | gold_v1 | sr_d2a6f3c9e2c444fd94496ea3fdd30f9e | sr_fe6b04f2fd644b86b6c89167ebb035a1 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>NCCS(=O)(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: APAP-treated hamsters (Mesocricetus auratus), in vivo, three to six animals per group; intact ... | (A) | train | de996192d4d7f86a471aee8df8198df6f6b49a5ef3be7c59e37e6054ce7a8472 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:3b7fbe8e584b862aef792235b051e8922b1d110d451c2852bf679ea6aeb04779 | dili:e95b60eec6736d3b87d0d1a110d065283935c315862ab97eab1215d5ccceb86f | dili:3b7fbe8e584b862aef792235b051e8922b1d110d451c2852bf679ea6aeb04779 | dili:e95b60eec6736d3b87d0d1a110d065283935c315862ab97eab1215d5ccceb86f | MUBZPKHOEPUJKR-UHFFFAOYSA-N | XOAAWQZATWQOTB-UHFFFAOYSA-N | O=C(O)C(=O)O | NCCS(=O)(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo with biliary collection; co-infused bile salts given intravenously; metabolically competent intact system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow... | [
"assay_format=in_vivo_animal",
"biological_system_context=APAP-treated hamsters (Mesocricetus auratus), in vivo, three to six animals per group; intact in vivo system, intrinsically metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 8.57 | 7.72 | 0.85 | 5.5845 | {
"nontransfer": 0.07741992560455091,
"transfer": 0.9225800743954491
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 0.85 | 0.152207 | 0.92258 | 5.5845 | 0.92258 | 0.07742 | safety_canonical_v27 | 1 | true | 0.111111 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | MUBZPKHOEPUJKR-UHFFFAOYSA-N | XOAAWQZATWQOTB-UHFFFAOYSA-N | parent:MUBZPKHOEPUJKR-UHFFFAOYSA-N | parent:XOAAWQZATWQOTB-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "8.57",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 8.57,
"aggregate_max": 8.57,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.72",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.72,
"aggregate_max": 7.72,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo with biliary collection; co-infused bile salts given intravenously; metabolically competent intact system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_directi... | {"assay_format":"in_vivo_animal","biological_system_context":"APAP-treated hamsters (Mesocricetus auratus), in vivo, three to six animals per group; intact in vivo system, intrinsically metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.75,"effe... | L4 | gold_v1 | sr_1e5923f03ece45689f88a1bd7f47a771 | sr_dd3de8c090584b9d9289080b8289b1a5 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3C(=O)C[C@@]21C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus) in vi... | (A) | train | e641da8aa15f7a3b124ad45890a0c2c4c40732ff3ca98f9930ca21489dab3dbe | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:6293265c0525f91cec51f01a12c2c59d8c90200c1337eedfb51a47c8937bb65d | dili:9dee46f49be1a7877c963e10dba295f26374aca2325f2e47d0dd418452eb56b3 | dili:6293265c0525f91cec51f01a12c2c59d8c90200c1337eedfb51a47c8937bb65d | dili:9dee46f49be1a7877c963e10dba295f26374aca2325f2e47d0dd418452eb56b3 | XAGFODPZIPBFFR-UHFFFAOYSA-N | ITRJWOMZKQRYTA-RFZYENFJSA-N | [Al] | CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3C(=O)C[C@@]21C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Adult rats (Rattus norvegicus), in vivo, intact organism; Al-intoxication model; bile flow collected under basal conditions.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"end... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile-acid-independent ... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 4.25 | 4.43 | 0.18 | 5.5845 | {
"nontransfer": 0.024658180264758744,
"transfer": 0.9753418197352413
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 0.18 | 0.032232 | 0.975342 | 5.5845 | 0.975342 | 0.024658 | safety_canonical_v27 | 1 | true | 0 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | XAGFODPZIPBFFR-UHFFFAOYSA-N | ITRJWOMZKQRYTA-RFZYENFJSA-N | parent:XAGFODPZIPBFFR-UHFFFAOYSA-N | O=C1C=C2CCC3C4CCCC4CC(=O)C3C2CC1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.25",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.25,
"aggregate_max": 4.25,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.43",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.43,
"aggregate_max": 4.43,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Adult rats (Rattus norvegicus), in vivo, intact organism; Al-intoxication model; bile flow collected under basal conditions.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"decrease",... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"no_change... | L4 | gold_v1 | sr_5829e25f0c084de3a9890aecb7e138c8 | sr_52188b0589eb43ada64e7fab1b5bd593 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>NCCC(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rattus norvegicus, in vivo bile collection, bile-salt-free isotope studies, β-alanine pretreated r... | (B) | train | 75a659746d7799ba1e6441c7ad9abc5aa7e6265e796c7123a3c167241badacdb | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:12ac9f43e5181b1a9d82fe21da0fb6145b6d579a65d1f315991994d183a60977 | dili:5efdf6a9f460b4828ceaf1c93eb1b3a761f982e94766e34784424d001483ec37 | dili:12ac9f43e5181b1a9d82fe21da0fb6145b6d579a65d1f315991994d183a60977 | dili:5efdf6a9f460b4828ceaf1c93eb1b3a761f982e94766e34784424d001483ec37 | DDBREPKUVSBGFI-UHFFFAOYSA-N | UCMIRNVEIXFBKS-UHFFFAOYSA-N | CCC1(c2ccccc2)C(=O)NC(=O)NC1=O | NCCC(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile-acid-independent ... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rattus norvegicus, in vivo bile collection, bile-salt-free isotope studies, β-alanine pretreated rats versus control rats",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoi... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 6.61 | 21.95 | 15.34 | 5.5845 | {
"nontransfer": 0.9999999999357916,
"transfer": 6.420840376137818e-11
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 15.34 | 2.746889 | 0 | 5.5845 | 0 | 1 | safety_canonical_v27 | 0 | true | 0.117647 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | DDBREPKUVSBGFI-UHFFFAOYSA-N | UCMIRNVEIXFBKS-UHFFFAOYSA-N | O=C1NC(=O)C(c2ccccc2)C(=O)N1 | parent:UCMIRNVEIXFBKS-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "6.61",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 6.61,
"aggregate_max": 6.61,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "21.95",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 21.95,
"aggregate_max": 21.95,
"aggregate... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase"... | {"assay_format":"in_vivo_animal","biological_system_context":"Rattus norvegicus, in vivo bile collection, bile-salt-free isotope studies, \u03b2-alanine pretreated rats versus control rats","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.8,"effect_direction":"increase... | L4 | gold_v1 | sr_5f1a4bc38132448192f150870527230c | sr_a1ac8787621642a595cf64eb57aa3bf9 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>O=C(O)C(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metab... | (B) | train | 2e34e7e79b0edf847880b31cb5c7c0f17f2bd8ee9ccd28892bb1082f53dc6c79 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:fdc0a5f33f0b9fee0aedc74bd2f7b99068b88362c0f38190e05bfc81aac2472a | dili:6323cf83ec5257a8d7a665b401a4d2b0196c3c6a4cd48ff522e6c5d597c4a644 | dili:fdc0a5f33f0b9fee0aedc74bd2f7b99068b88362c0f38190e05bfc81aac2472a | dili:6323cf83ec5257a8d7a665b401a4d2b0196c3c6a4cd48ff522e6c5d597c4a644 | XAGFODPZIPBFFR-UHFFFAOYSA-N | MUBZPKHOEPUJKR-UHFFFAOYSA-N | [Al] | O=C(O)C(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rattus norvegicus rats, chronic Al-intoxication model, in vivo basal bile collection, n=6; intrinsically metabolically competent in vivo system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bil... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 4.25 | 1.87 | 2.38 | 5.5845 | {
"nontransfer": 0.5650777442831008,
"transfer": 0.4349222557168992
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 2.38 | 0.42618 | 0.434922 | 5.5845 | 0.434922 | 0.565078 | safety_canonical_v27 | 0 | false | 0 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | XAGFODPZIPBFFR-UHFFFAOYSA-N | MUBZPKHOEPUJKR-UHFFFAOYSA-N | parent:XAGFODPZIPBFFR-UHFFFAOYSA-N | parent:MUBZPKHOEPUJKR-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.25",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.25,
"aggregate_max": 4.25,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "1.87",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 1.87,
"aggregate_max": 1.87,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rattus norvegicus rats, chronic Al-intoxication model, in vivo basal bile collection, n=6; intrinsically metabolically competent in vivo system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.88,"effect_d... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"decrea... | L4 | gold_v1 | sr_1447743d61614aa7b100609c04fb224c | sr_d600728bdfb849beb6d6bda1d35afcf8 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>O=C(O)C(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus) in vivo with biliary collection; co-infused bile salts given intravenou... | (B) | train | 8ecbfc8f9ddb3fb54ce7a74b4473802f31e8692d678e744fdf54e30fce48ad22 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:5efdf6a9f460b4828ceaf1c93eb1b3a761f982e94766e34784424d001483ec37 | dili:3b7fbe8e584b862aef792235b051e8922b1d110d451c2852bf679ea6aeb04779 | dili:5efdf6a9f460b4828ceaf1c93eb1b3a761f982e94766e34784424d001483ec37 | dili:3b7fbe8e584b862aef792235b051e8922b1d110d451c2852bf679ea6aeb04779 | UCMIRNVEIXFBKS-UHFFFAOYSA-N | MUBZPKHOEPUJKR-UHFFFAOYSA-N | NCCC(=O)O | O=C(O)C(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rattus norvegicus, in vivo bile collection, bile-salt-free isotope studies, β-alanine pretreated rats versus control rats",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoi... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo with biliary collection; co-infused bile salts given intravenously; metabolically competent intact system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 21.95 | 8.57 | 13.38 | 5.5845 | {
"nontransfer": 0.9999999978529535,
"transfer": 2.1470465456579016e-9
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 13.38 | 2.395917 | 0 | 5.5845 | 0 | 1 | safety_canonical_v27 | 0 | true | 0.266667 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | UCMIRNVEIXFBKS-UHFFFAOYSA-N | MUBZPKHOEPUJKR-UHFFFAOYSA-N | parent:UCMIRNVEIXFBKS-UHFFFAOYSA-N | parent:MUBZPKHOEPUJKR-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "21.95",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 21.95,
"aggregate_max": 21.95,
"aggregate... | {
"aggregation_method": "individual_record",
"display_measurement_text": "8.57",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 8.57,
"aggregate_max": 8.57,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rattus norvegicus, in vivo bile collection, bile-salt-free isotope studies, \u03b2-alanine pretreated rats versus control rats","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.8,"effect_direction":"increase... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo with biliary collection; co-infused bile salts given intravenously; metabolically competent intact system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_directi... | L4 | gold_v1 | sr_a1ac8787621642a595cf64eb57aa3bf9 | sr_1e5923f03ece45689f88a1bd7f47a771 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus) in viv... | (B) | train | 7d8b24eff6c2c5a6a215845a9268d995491b969ff82e0771b1d71b03552b6b83 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:9efa179c73816a18f1a7e820124cab39565b7cf7e91fee502d68e5fed1f83075 | dili:182e1713eb9965d45677af92b3e9f1e05f2bd9cce55eea95950a5c4623b57081 | dili:9efa179c73816a18f1a7e820124cab39565b7cf7e91fee502d68e5fed1f83075 | dili:182e1713eb9965d45677af92b3e9f1e05f2bd9cce55eea95950a5c4623b57081 | GVJHHUAWPYXKBD-IEOSBIPESA-N | MECYMOKOKLARJV-PCNQZJBLSA-N | Cc1c(C)c2c(c(C)c1O)CC[C@@](C)(CCC[C@H](C)CCC[C@H](C)CCCC(C)C)O2 | C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rattus norvegicus rats, chronic Al-intoxication model with Vit E coadministration, in vivo basal bile collection, n=6.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 6.51 | 0.27 | 6.24 | 5.5845 | {
"nontransfer": 0.999234170249857,
"transfer": 0.0007658297501430878
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 6.24 | 1.117378 | 0.000766 | 5.5845 | 0.000766 | 0.999234 | safety_canonical_v27 | 0 | true | 0.11828 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | GVJHHUAWPYXKBD-IEOSBIPESA-N | MECYMOKOKLARJV-PCNQZJBLSA-N | c1ccc2c(c1)CCCO2 | C1=C2CCCCC2C2CCC3CCCC3C2C1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "6.51",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 6.51,
"aggregate_max": 6.51,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "0.27",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 0.27,
"aggregate_max": 0.27,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rattus norvegicus rats, chronic Al-intoxication model with Vit E coadministration, in vivo basal bile collection, n=6.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.88,"effect_direction":"increase","endp... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"decrea... | L4 | gold_v1 | sr_d19213833dea4a8880e9dfe814d229ea | sr_5916d18874cd46a487a6aef7541223af | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CC(O)CO</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as... | (B) | train | 166141ea37b89a168f805aedb6e833f2843d7360a5968a7262f85199f5307dec | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:daef7ee17eae0383aec6c740eb0c3ca773f85a7d3cd050a9db2bd665421fa71d | dili:642f46db98fcfefd64b860bfa2d29ab4e81b49349142e96c276dc0184d6017ef | dili:daef7ee17eae0383aec6c740eb0c3ca773f85a7d3cd050a9db2bd665421fa71d | dili:642f46db98fcfefd64b860bfa2d29ab4e81b49349142e96c276dc0184d6017ef | OCZNOKJDQKWBTM-UHFFFAOYSA-N | DNIAPMSPPWPWGF-UHFFFAOYSA-N | CC(C)(C)C(C)(C)Cc1ccc(OCCO)c(Cc2cc(CC(C)(C)C(C)(C)C)cc(Cc3cc(CC(C)(C)C(C)(C)C)ccc3OCCO)c2OCCO)c1 | CC(O)CO | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo rat (Rattus norvegicus) liver; six animals per group; intact in vivo system (intrinsically metabolically competent).",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=basal bile flow rate",
... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile-acid-independent ... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 7.8 | 4.79 | 3.01 | 5.5845 | {
"nontransfer": 0.8005792330938271,
"transfer": 0.1994207669061729
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 3.01 | 0.538992 | 0.199421 | 5.5845 | 0.199421 | 0.800579 | safety_canonical_v27 | 0 | true | 0.088889 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | OCZNOKJDQKWBTM-UHFFFAOYSA-N | DNIAPMSPPWPWGF-UHFFFAOYSA-N | c1ccc(Cc2cccc(Cc3ccccc3)c2)cc1 | parent:DNIAPMSPPWPWGF-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.8",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.8,
"aggregate_max": 7.8,
"aggregate_q1": ... | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.79",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.79,
"aggregate_max": 4.79,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo rat (Rattus norvegicus) liver; six animals per group; intact in vivo system (intrinsically metabolically competent).","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.8,"effect_direction":"increase",... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"no_change... | L4 | gold_v1 | sr_153eb54cece64d7bbc5ec955a7f8f309 | sr_b051effdb7c548f7ac1a6aa1a01994a4 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus) in viv... | (B) | train | 219c5181d002979089e6087c5114d7ec32e20728130a548ee0303978fdb5caf5 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:cdc7b538cd367a59ebd7842a083e6e368139d1174b1556a671e84f3136199f86 | dili:182e1713eb9965d45677af92b3e9f1e05f2bd9cce55eea95950a5c4623b57081 | dili:cdc7b538cd367a59ebd7842a083e6e368139d1174b1556a671e84f3136199f86 | dili:182e1713eb9965d45677af92b3e9f1e05f2bd9cce55eea95950a5c4623b57081 | BHTRKEVKTKCXOH-LBSADWJPSA-N | MECYMOKOKLARJV-PCNQZJBLSA-N | C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo rat biliary excretion study; species Rattus norvegicus; intact metabolic competence",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate during Tm period",
"endpoint_name=bilia... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 15.9 | 0.27 | 15.63 | 5.5845 | {
"nontransfer": 0.9999999999617999,
"transfer": 3.8200157081136816e-11
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 15.63 | 2.798818 | 0 | 5.5845 | 0 | 1 | safety_canonical_v27 | 0 | true | 0.608108 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | BHTRKEVKTKCXOH-LBSADWJPSA-N | MECYMOKOKLARJV-PCNQZJBLSA-N | C1CCC2C(C1)CCC1C3CCCC3CCC21 | C1=C2CCCCC2C2CCC3CCCC3C2C1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "15.9",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 15.9,
"aggregate_max": 15.9,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "0.27",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 0.27,
"aggregate_max": 0.27,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo rat biliary excretion study; species Rattus norvegicus; intact metabolic competence","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"present","endpoint_metric":"bile flow rate ... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"decrea... | L4 | gold_v1 | sr_9a6596cb8a914ad4871d994a3d52c1f9 | sr_5916d18874cd46a487a6aef7541223af | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>NCCC(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus), in vivo, bile-collection model; β-alanine-pretreated (taurine depletion) ... | (B) | train | 5cd46cadc045711be25508c9b031f2271a9a420a738a8b3896005abc115083d1 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:bbe7c9cb57f743e44885a7c45a1fff29fdd54a0470486dac89653fb7d6254e84 | dili:79711e38deb67325affb51896f2dc6386c59f0b9d653e2b0daa75e2c463fcbf4 | dili:bbe7c9cb57f743e44885a7c45a1fff29fdd54a0470486dac89653fb7d6254e84 | dili:79711e38deb67325affb51896f2dc6386c59f0b9d653e2b0daa75e2c463fcbf4 | UEEJHVSXFDXPFK-UHFFFAOYSA-N | UCMIRNVEIXFBKS-UHFFFAOYSA-N | CN(C)CCO | NCCC(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Adult male Wistar rats with an external bile fistula and jugular catheter, in vivo; baseline saline infusion to wash out endogenous bile salt pool.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus), in vivo, bile-collection model; β-alanine-pretreated (taurine depletion) rats coinfused TCDC+UDC (group F); intact metabolic competence.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"en... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 2.3 | 18.27 | 15.97 | 9.325017 | {
"nontransfer": 0.9999980072126905,
"transfer": 0.0000019927873094464175
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 15.97 | 1.712597 | 0.000002 | 9.325017 | 0.000002 | 0.999998 | safety_canonical_v27 | 0 | true | 0.086957 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | UEEJHVSXFDXPFK-UHFFFAOYSA-N | UCMIRNVEIXFBKS-UHFFFAOYSA-N | parent:UEEJHVSXFDXPFK-UHFFFAOYSA-N | parent:UCMIRNVEIXFBKS-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "2.3",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2.3,
"aggregate_max": 2.3,
"aggregate_q1": 2.3,
"aggr... | {
"aggregation_method": "individual_record",
"display_measurement_text": "18.27",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 18.27,
"aggregate_max": 18.27,
"aggregate_q1": 18.27,... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Adult male Wistar rats with an external bile fistula and jugular catheter, in vivo; baseline saline infusion to wash out endogenous bile salt pool.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus), in vivo, bile-collection model; \u03b2-alanine-pretreated (taurine depletion) rats coinfused TCDC+UDC (group F); intact metabolic competence.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","conf... | L4 | gold_v1 | sr_e23e2eaa4b19487281e3ca47eec1d24c | sr_c369c3f6667e4396b11581e21f34079e | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: In vivo mal... | (A) | train | 50c143f0026cfad4de18ec1977f1997ceabac78fb2e52fa42c5686004506662e | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:79711e38deb67325affb51896f2dc6386c59f0b9d653e2b0daa75e2c463fcbf4 | dili:ae3f62ea784940a5875c7864839486fee1f002880101a68f8ab7cefa8e9e86a6 | dili:79711e38deb67325affb51896f2dc6386c59f0b9d653e2b0daa75e2c463fcbf4 | dili:ae3f62ea784940a5875c7864839486fee1f002880101a68f8ab7cefa8e9e86a6 | UCMIRNVEIXFBKS-UHFFFAOYSA-N | DKPMWHFRUGMUKF-CRKPLTDNSA-N | NCCC(=O)O | C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus), in vivo, bile-collection model; β-alanine-pretreated (taurine depletion) rats coinfused TCDC+UDC (group F); intact metabolic competence.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"en... | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_me... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 18.27 | 18.85 | 0.58 | 9.325017 | {
"nontransfer": 0.0329895896082526,
"transfer": 0.9670104103917474
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 0.58 | 0.062198 | 0.96701 | 9.325017 | 0.96701 | 0.03299 | safety_canonical_v27 | 1 | true | 0.16 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | UCMIRNVEIXFBKS-UHFFFAOYSA-N | DKPMWHFRUGMUKF-CRKPLTDNSA-N | parent:UCMIRNVEIXFBKS-UHFFFAOYSA-N | C1CCC2C(C1)CCC1C3CCCC3CCC21 | {
"aggregation_method": "individual_record",
"display_measurement_text": "18.27",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 18.27,
"aggregate_max": 18.27,
"aggregate_q1": 18.27,... | {
"aggregation_method": "individual_record",
"display_measurement_text": "18.85",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 18.85,
"aggregate_max": 18.85,
"aggregate_q1": 18.85,... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus), in vivo, bile-collection model; \u03b2-alanine-pretreated (taurine depletion) rats coinfused TCDC+UDC (group F); intact metabolic competence.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","conf... | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"... | L4 | gold_v1 | sr_c369c3f6667e4396b11581e21f34079e | sr_e0dd87d38fae4210ae54dbe4c0107f6b | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>O=S(=O)(O)OS(=O)(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: In vivo bile-collection study; Sprague-Dawley rats (n=3-4 experiments). Intact animal,... | (A) | train | c264a32e8273ef68d3d68e874de8b60c90665e50dd238eab099825e7631be51b | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:32e00f1154dbb58ce37df0104fe3b80ee3378363957e182b93c27559330908f4 | dili:e95335d99af822c5d343f9a88c23c529c7627dca123ac0d13f0da13743177049 | dili:32e00f1154dbb58ce37df0104fe3b80ee3378363957e182b93c27559330908f4 | dili:e95335d99af822c5d343f9a88c23c529c7627dca123ac0d13f0da13743177049 | DKPMWHFRUGMUKF-CRKPLTDNSA-N | VFNGKCDDZUSWLR-UHFFFAOYSA-N | C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | O=S(=O)(O)OS(=O)(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo bile-collection study; Sprague-Dawley rats (n=3-4 experiments). Intact animal, intrinsically metabolically competent per protocol.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow... | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo bile-collection study; Sprague-Dawley rats (n=3-4 experiments). Intact animal, intrinsically metabolically competent per protocol.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 13 | 14.9 | 1.9 | 9.325017 | {
"nontransfer": 0.12319996494587304,
"transfer": 0.876800035054127
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 1.9 | 0.203753 | 0.8768 | 9.325017 | 0.8768 | 0.1232 | safety_canonical_v27 | 1 | true | 0.037736 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | DKPMWHFRUGMUKF-CRKPLTDNSA-N | VFNGKCDDZUSWLR-UHFFFAOYSA-N | C1CCC2C(C1)CCC1C3CCCC3CCC21 | parent:VFNGKCDDZUSWLR-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "13",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 13,
"aggregate_max": 13,
"aggregate_q1": 13,
"aggregat... | {
"aggregation_method": "individual_record",
"display_measurement_text": "14.9",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 14.9,
"aggregate_max": 14.9,
"aggregate_q1": 14.9,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo bile-collection study; Sprague-Dawley rats (n=3-4 experiments). Intact animal, intrinsically metabolically competent per protocol.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_directio... | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo bile-collection study; Sprague-Dawley rats (n=3-4 experiments). Intact animal, intrinsically metabolically competent per protocol.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_directio... | L4 | gold_v1 | sr_94f588ab3baa4327a97d1d188f52e534 | sr_654bdd09cb604a5fb88584a399179675 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CCSCC[C@H](N)C(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group
- C... | (B) | train | d0507b9457c30cb26ba1d760078ba3c2608eacbb98a51d7153c0d6094d4d0e70 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:8130a61e464897b7b951670ffdf271fd0de7852501950e364cec1d6ba39c6910 | dili:40647c681f6bc3cab99cb8a92b684c56c05243b67622d3ed853b6b394ef58693 | dili:8130a61e464897b7b951670ffdf271fd0de7852501950e364cec1d6ba39c6910 | dili:40647c681f6bc3cab99cb8a92b684c56c05243b67622d3ed853b6b394ef58693 | KPSRODZRAIWAKH-UHFFFAOYSA-N | GGLZPLKKBSSKCX-YFKPBYRVSA-N | CC(C)(Oc1ccc(C2CC2(Cl)Cl)cc1)C(=O)O | CCSCC[C@H](N)C(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Male wild-type mice (Mus musculus); in vivo bile collection; metabolic competence: intact in vivo system; units per 100 g body weight",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate... | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 30.3 | 4.11 | 26.19 | 9.325017 | {
"nontransfer": 0.9999999999653506,
"transfer": 3.4649429323306e-11
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 26.19 | 2.808574 | 0 | 9.325017 | 0 | 1 | safety_canonical_v27 | 0 | true | 0.12 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | KPSRODZRAIWAKH-UHFFFAOYSA-N | GGLZPLKKBSSKCX-YFKPBYRVSA-N | c1ccc(C2CC2)cc1 | parent:GGLZPLKKBSSKCX-YFKPBYRVSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "30.3",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 30.3,
"aggregate_max": 30.3,
"aggregate_q1": 30.3,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.11",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.11,
"aggregate_max": 4.11,
"aggregate_q1": 4.11,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Male wild-type mice (Mus musculus); in vivo bile collection; metabolic competence: intact in vivo system; units per 100 g body weight","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"i... | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"increase","endpoint_metric":"bile flow rate","end... | L4 | gold_v1 | sr_19655acb45a14205aca1078fbaec5115 | sr_3e35e9025cd54d798701ec3ad7e71a9a | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CCSCC[C@H](N)C(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group
- C... | (B) | train | e8b9cf3948da177491c511096cce0af629cfee00f58832caa97c77823e7bf078 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:cb323b9f1c7dd04805b87ba450736683b22e79809056020d5364181aa974bac0 | dili:40647c681f6bc3cab99cb8a92b684c56c05243b67622d3ed853b6b394ef58693 | dili:cb323b9f1c7dd04805b87ba450736683b22e79809056020d5364181aa974bac0 | dili:40647c681f6bc3cab99cb8a92b684c56c05243b67622d3ed853b6b394ef58693 | KPSRODZRAIWAKH-UHFFFAOYSA-N | GGLZPLKKBSSKCX-YFKPBYRVSA-N | CC(C)(Oc1ccc(C2CC2(Cl)Cl)cc1)C(=O)O | CCSCC[C@H](N)C(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Wild-type and Pparα(-/-) SV129 mice, in vivo bile collection (n=7-10 per group); intrinsically metabolically competent in vivo system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rat... | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 30.3 | 4.11 | 26.19 | 9.325017 | {
"nontransfer": 0.9999999999653506,
"transfer": 3.4649429323306e-11
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 26.19 | 2.808574 | 0 | 9.325017 | 0 | 1 | safety_canonical_v27 | 0 | true | 0.12 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | KPSRODZRAIWAKH-UHFFFAOYSA-N | GGLZPLKKBSSKCX-YFKPBYRVSA-N | c1ccc(C2CC2)cc1 | parent:GGLZPLKKBSSKCX-YFKPBYRVSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "30.3",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 30.3,
"aggregate_max": 30.3,
"aggregate_q1": 30.3,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.11",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.11,
"aggregate_max": 4.11,
"aggregate_q1": 4.11,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Wild-type and Ppar\u03b1(-/-) SV129 mice, in vivo bile collection (n=7-10 per group); intrinsically metabolically competent in vivo system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_directi... | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"increase","endpoint_metric":"bile flow rate","end... | L4 | gold_v1 | sr_38ddc4a129ed4f1d9623f10dbfa65e9f | sr_3e35e9025cd54d798701ec3ad7e71a9a | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>COC(=O)C1=CO[C@@H](O)[C@@H]2C(CO)=CC[C@H]12</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Sprague-Dawley rats, in vivo bile collection
- Canonical assay c... | (A) | train | 89414e666f6ee73ce256641974327fc99aedab6cc076258839df1238a66968ae | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:8594b20023e2972b71590f545290aca80cb67a1a24387f80a4d98de5b6379f74 | dili:a1d3ebcf5f469c0a632cab858b2c72c97e6273d2e9f60c1096da3d9ff4984acb | dili:8594b20023e2972b71590f545290aca80cb67a1a24387f80a4d98de5b6379f74 | dili:a1d3ebcf5f469c0a632cab858b2c72c97e6273d2e9f60c1096da3d9ff4984acb | YPHMISFOHDHNIV-FSZOTQKASA-N | AZKVWQKMDGGDSV-BCMRRPTOSA-N | C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1 | COC(=O)C1=CO[C@@H](O)[C@@H]2C(CO)=CC[C@H]12 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | [
"assay_format=in_vivo_animal",
"biological_system_context=Sprague-Dawley rats, in vivo bile collection",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flow",
"exposure_conditions=genipin orall... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 6.8 | 7.02 | 0.22 | 9.325017 | {
"nontransfer": 0.022663495967353064,
"transfer": 0.9773365040326469
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 0.22 | 0.023592 | 0.977337 | 9.325017 | 0.977337 | 0.022663 | safety_canonical_v27 | 1 | true | 0.106061 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | YPHMISFOHDHNIV-FSZOTQKASA-N | AZKVWQKMDGGDSV-BCMRRPTOSA-N | O=C1CC(CCC2CCCCC2=O)CC(=O)N1 | C1=CC2COC=CC2C1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "6.8",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 6.8,
"aggregate_max": 6.8,
"aggregate_q1": 6.8,
"aggr... | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.02",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.02,
"aggregate_max": 7.02,
"aggregate_q1": 7.02,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase","endpoint_metric":"bile flow rate","endp... | {"assay_format":"in_vivo_animal","biological_system_context":"Sprague-Dawley rats, in vivo bile collection","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase","endpoint_metric":"bile flow rate","endpoint_name":"biliary_secretion_or_bile_fl... | L4 | gold_v1 | sr_8671a76ad38344b594755b5d2d018137 | sr_0c9d68f22b534e68a2076c18bcb48111 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CC(C)(Oc1ccc(C2CC2(Cl)Cl)cc1)C(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Male wild-type mice (Mus musculus); in vivo bile collection; metabolic c... | (B) | train | d9466b2079b9ecbd9a960b755fd12a81e00a3e8f8bd8ec1ec9a2b7b1502bc299 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:a1d3ebcf5f469c0a632cab858b2c72c97e6273d2e9f60c1096da3d9ff4984acb | dili:8130a61e464897b7b951670ffdf271fd0de7852501950e364cec1d6ba39c6910 | dili:a1d3ebcf5f469c0a632cab858b2c72c97e6273d2e9f60c1096da3d9ff4984acb | dili:8130a61e464897b7b951670ffdf271fd0de7852501950e364cec1d6ba39c6910 | AZKVWQKMDGGDSV-BCMRRPTOSA-N | KPSRODZRAIWAKH-UHFFFAOYSA-N | COC(=O)C1=CO[C@@H](O)[C@@H]2C(CO)=CC[C@H]12 | CC(C)(Oc1ccc(C2CC2(Cl)Cl)cc1)C(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Sprague-Dawley rats, in vivo bile collection",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flow",
"exposure_conditions=genipin orall... | [
"assay_format=in_vivo_animal",
"biological_system_context=Male wild-type mice (Mus musculus); in vivo bile collection; metabolic competence: intact in vivo system; units per 100 g body weight",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 7.02 | 30.3 | 23.28 | 9.325017 | {
"nontransfer": 0.9999999992148153,
"transfer": 7.851847318082662e-10
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 23.28 | 2.49651 | 0 | 9.325017 | 0 | 1 | safety_canonical_v27 | 0 | true | 0.145161 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | AZKVWQKMDGGDSV-BCMRRPTOSA-N | KPSRODZRAIWAKH-UHFFFAOYSA-N | C1=CC2COC=CC2C1 | c1ccc(C2CC2)cc1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.02",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.02,
"aggregate_max": 7.02,
"aggregate_q1": 7.02,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "30.3",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 30.3,
"aggregate_max": 30.3,
"aggregate_q1": 30.3,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Sprague-Dawley rats, in vivo bile collection","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase","endpoint_metric":"bile flow rate","endpoint_name":"biliary_secretion_or_bile_fl... | {"assay_format":"in_vivo_animal","biological_system_context":"Male wild-type mice (Mus musculus); in vivo bile collection; metabolic competence: intact in vivo system; units per 100 g body weight","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"i... | L4 | gold_v1 | sr_0c9d68f22b534e68a2076c18bcb48111 | sr_19655acb45a14205aca1078fbaec5115 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>Cc1c(C)c2c(c(C)c1O)CC[C@@](C)(CCC[C@H](C)CCC[C@H](C)CCCC(C)C)O2</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rattus norvegicus rats, chronic Al-intoxicat... | (A) | train | b83c237b4b9652d4e2a5e9a18cd383f25665d99e0aac1a82a9a8686fc2286c70 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:9dee46f49be1a7877c963e10dba295f26374aca2325f2e47d0dd418452eb56b3 | dili:9efa179c73816a18f1a7e820124cab39565b7cf7e91fee502d68e5fed1f83075 | dili:9dee46f49be1a7877c963e10dba295f26374aca2325f2e47d0dd418452eb56b3 | dili:9efa179c73816a18f1a7e820124cab39565b7cf7e91fee502d68e5fed1f83075 | ITRJWOMZKQRYTA-RFZYENFJSA-N | GVJHHUAWPYXKBD-IEOSBIPESA-N | CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3C(=O)C[C@@]21C | Cc1c(C)c2c(c(C)c1O)CC[C@@](C)(CCC[C@H](C)CCC[C@H](C)CCCC(C)C)O2 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile-acid-independent ... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rattus norvegicus rats, chronic Al-intoxication model with Vit E coadministration, in vivo basal bile collection, n=6.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 4.43 | 6.51 | 2.08 | 5.5845 | {
"nontransfer": 0.4315806227034461,
"transfer": 0.5684193772965539
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 2.08 | 0.372459 | 0.568419 | 5.5845 | 0.568419 | 0.431581 | safety_canonical_v27 | 1 | false | 0.103448 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ITRJWOMZKQRYTA-RFZYENFJSA-N | GVJHHUAWPYXKBD-IEOSBIPESA-N | O=C1C=C2CCC3C4CCCC4CC(=O)C3C2CC1 | c1ccc2c(c1)CCCO2 | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.43",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.43,
"aggregate_max": 4.43,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "6.51",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 6.51,
"aggregate_max": 6.51,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"no_change... | {"assay_format":"in_vivo_animal","biological_system_context":"Rattus norvegicus rats, chronic Al-intoxication model with Vit E coadministration, in vivo basal bile collection, n=6.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.88,"effect_direction":"increase","endp... | L4 | gold_v1 | sr_52188b0589eb43ada64e7fab1b5bd593 | sr_d19213833dea4a8880e9dfe814d229ea | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>NCCC(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus), in vivo, bile-collection model; β-alanine-pretreated (taurine depletion) ... | (A) | train | fd7248638cbb6ccf941627be77916df45bac2d58f352b10ce7885bb7a53d4cd4 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:585216628833c092b974ed7686b0d83aa37d683d966c2bc8891183857cdba3f3 | dili:79711e38deb67325affb51896f2dc6386c59f0b9d653e2b0daa75e2c463fcbf4 | dili:585216628833c092b974ed7686b0d83aa37d683d966c2bc8891183857cdba3f3 | dili:79711e38deb67325affb51896f2dc6386c59f0b9d653e2b0daa75e2c463fcbf4 | DKPMWHFRUGMUKF-GDYCBZMLSA-N | UCMIRNVEIXFBKS-UHFFFAOYSA-N | C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | NCCC(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_me... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus), in vivo, bile-collection model; β-alanine-pretreated (taurine depletion) rats coinfused TCDC+UDC (group F); intact metabolic competence.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"en... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 18.76 | 18.27 | 0.49 | 9.325017 | {
"nontransfer": 0.030045630504188625,
"transfer": 0.9699543694958114
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 0.49 | 0.052547 | 0.969954 | 9.325017 | 0.969954 | 0.030046 | safety_canonical_v27 | 1 | true | 0.16 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | DKPMWHFRUGMUKF-GDYCBZMLSA-N | UCMIRNVEIXFBKS-UHFFFAOYSA-N | C1CCC2C(C1)CCC1C3CCCC3CCC21 | parent:UCMIRNVEIXFBKS-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "18.76",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 18.76,
"aggregate_max": 18.76,
"aggregate_q1": 18.76,... | {
"aggregation_method": "individual_record",
"display_measurement_text": "18.27",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 18.27,
"aggregate_max": 18.27,
"aggregate_q1": 18.27,... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus), in vivo, bile-collection model; \u03b2-alanine-pretreated (taurine depletion) rats coinfused TCDC+UDC (group F); intact metabolic competence.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","conf... | L4 | gold_v1 | sr_2e7e6b62948e4bee8840080aec5c1f56 | sr_c369c3f6667e4396b11581e21f34079e | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: In vivo bil... | (B) | train | 91f9fa28508805c025ac211546a1bffe81d8a0bff9cfb5b7f472e4f9259a4df7 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:530894f53b6346e450e3f5214ee1f0722c91914516a7f04b74de05630d295473 | dili:32e00f1154dbb58ce37df0104fe3b80ee3378363957e182b93c27559330908f4 | dili:530894f53b6346e450e3f5214ee1f0722c91914516a7f04b74de05630d295473 | dili:32e00f1154dbb58ce37df0104fe3b80ee3378363957e182b93c27559330908f4 | WEXRUCMBJFQVBZ-UHFFFAOYSA-N | DKPMWHFRUGMUKF-CRKPLTDNSA-N | CCCC(C)C1(CC)C(=O)NC(=O)NC1=O | C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo rats (Rattus norvegicus) with eight days biliary drainage (BD group); metabolically competent intact in vivo system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile acid-independent f... | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo bile-collection study; Sprague-Dawley rats (n=3-4 experiments). Intact animal, intrinsically metabolically competent per protocol.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 2.38 | 13 | 10.62 | 9.325017 | {
"nontransfer": 0.9993821947330528,
"transfer": 0.0006178052669472063
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 10.62 | 1.138872 | 0.000618 | 9.325017 | 0.000618 | 0.999382 | safety_canonical_v27 | 0 | true | 0.111111 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | WEXRUCMBJFQVBZ-UHFFFAOYSA-N | DKPMWHFRUGMUKF-CRKPLTDNSA-N | O=C1CC(=O)NC(=O)N1 | C1CCC2C(C1)CCC1C3CCCC3CCC21 | {
"aggregation_method": "individual_record",
"display_measurement_text": "2.38",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2.38,
"aggregate_max": 2.38,
"aggregate_q1": 2.38,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "13",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 13,
"aggregate_max": 13,
"aggregate_q1": 13,
"aggregat... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo rats (Rattus norvegicus) with eight days biliary drainage (BD group); metabolically competent intact in vivo system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.8,"effect_direction":"increase",... | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo bile-collection study; Sprague-Dawley rats (n=3-4 experiments). Intact animal, intrinsically metabolically competent per protocol.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_directio... | L4 | gold_v1 | sr_fe6b04f2fd644b86b6c89167ebb035a1 | sr_94f588ab3baa4327a97d1d188f52e534 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>COC(=O)C1=CO[C@@H](O)[C@@H]2C(CO)=CC[C@H]12</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Sprague-Dawley rats, in vivo bile collection
- Canonical assay c... | (A) | train | ecdd0915089f1c983a8f01ed3b2b11fad527bf5968cc95e50119bd896cd03490 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:21c4e80fadd27673efd0e708e1809b2464e24a8e6dafceba42d0fd9f9e9e9717 | dili:a1d3ebcf5f469c0a632cab858b2c72c97e6273d2e9f60c1096da3d9ff4984acb | dili:21c4e80fadd27673efd0e708e1809b2464e24a8e6dafceba42d0fd9f9e9e9717 | dili:a1d3ebcf5f469c0a632cab858b2c72c97e6273d2e9f60c1096da3d9ff4984acb | YPHMISFOHDHNIV-FSZOTQKASA-N | AZKVWQKMDGGDSV-BCMRRPTOSA-N | C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1 | COC(=O)C1=CO[C@@H](O)[C@@H]2C(CO)=CC[C@H]12 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat in vivo; bile collection with maximal bile-acid stimulation, 16 h after cycloheximide",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=maximal bile flow",
"endpoint_name=biliary_secretion_or_... | [
"assay_format=in_vivo_animal",
"biological_system_context=Sprague-Dawley rats, in vivo bile collection",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flow",
"exposure_conditions=genipin orall... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 10.6 | 7.02 | 3.58 | 9.325017 | {
"nontransfer": 0.4598702799125791,
"transfer": 0.5401297200874209
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 3.58 | 0.383914 | 0.54013 | 9.325017 | 0.54013 | 0.45987 | safety_canonical_v27 | 1 | false | 0.106061 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | YPHMISFOHDHNIV-FSZOTQKASA-N | AZKVWQKMDGGDSV-BCMRRPTOSA-N | O=C1CC(CCC2CCCCC2=O)CC(=O)N1 | C1=CC2COC=CC2C1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "10.6",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 10.6,
"aggregate_max": 10.6,
"aggregate_q1": 10.6,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.02",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.02,
"aggregate_max": 7.02,
"aggregate_q1": 7.02,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat in vivo; bile collection with maximal bile-acid stimulation, 16 h after cycloheximide","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"decrease","endpoint_metric":"maximal bile fl... | {"assay_format":"in_vivo_animal","biological_system_context":"Sprague-Dawley rats, in vivo bile collection","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase","endpoint_metric":"bile flow rate","endpoint_name":"biliary_secretion_or_bile_fl... | L4 | gold_v1 | sr_87527682a95540b7ab2d5d24cc3ade6e | sr_0c9d68f22b534e68a2076c18bcb48111 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CC(C)(C)C(C)(C)Cc1ccc(OCCO)c(Cc2cc(CC(C)(C)C(C)(C)C)cc(Cc3cc(CC(C)(C)C(C)(C)C)ccc3OCCO)c2OCCO)c1</SMILES>
- Assay format: in_vivo_animal
- Biological system context: In vivo rat... | (A) | train | 1932db0caef3285e231c99079084044fa98b1973019e469aecf58ac7e456d59b | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:92e4e559cb6021ffa17757dbd3d0e5a6057fed83c2a26fdc5930ba6ef0a55876 | dili:daef7ee17eae0383aec6c740eb0c3ca773f85a7d3cd050a9db2bd665421fa71d | dili:92e4e559cb6021ffa17757dbd3d0e5a6057fed83c2a26fdc5930ba6ef0a55876 | dili:daef7ee17eae0383aec6c740eb0c3ca773f85a7d3cd050a9db2bd665421fa71d | IAKHMKGGTNLKSZ-INIZCTEOSA-N | OCZNOKJDQKWBTM-UHFFFAOYSA-N | COc1cc2c(c(OC)c1OC)-c1ccc(OC)c(=O)cc1[C@@H](NC(C)=O)CC2 | CC(C)(C)C(C)(C)Cc1ccc(OCCO)c(Cc2cc(CC(C)(C)C(C)(C)C)cc(Cc3cc(CC(C)(C)C(C)(C)C)ccc3OCCO)c2OCCO)c1 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rattus norvegicus (rat), intact in vivo system (metabolically competent), colchicine-treated for 8 hr; bile collected and measured.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",... | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo rat (Rattus norvegicus) liver; six animals per group; intact in vivo system (intrinsically metabolically competent).",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=basal bile flow rate",
... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 7.4 | 7.8 | 0.4 | 5.5845 | {
"nontransfer": 0.03613352183470764,
"transfer": 0.9638664781652924
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 0.4 | 0.071627 | 0.963866 | 5.5845 | 0.963866 | 0.036134 | safety_canonical_v27 | 1 | true | 0.12987 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | IAKHMKGGTNLKSZ-INIZCTEOSA-N | OCZNOKJDQKWBTM-UHFFFAOYSA-N | O=c1cccc2c(c1)CCCc1ccccc1-2 | c1ccc(Cc2cccc(Cc3ccccc3)c2)cc1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.4",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.4,
"aggregate_max": 7.4,
"aggregate_q1": ... | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.8",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.8,
"aggregate_max": 7.8,
"aggregate_q1": ... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rattus norvegicus (rat), intact in vivo system (metabolically competent), colchicine-treated for 8 hr; bile collected and measured.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"dec... | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo rat (Rattus norvegicus) liver; six animals per group; intact in vivo system (intrinsically metabolically competent).","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.8,"effect_direction":"increase",... | L4 | gold_v1 | sr_91bbdf701b3d4cbfa8023dcfc56fb2e7 | sr_153eb54cece64d7bbc5ec955a7f8f309 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CC(C)(Oc1ccc(C2CC2(Cl)Cl)cc1)C(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Wild-type and Pparα(-/-) SV129 mice, in vivo bile collection (n=7-10 per... | (B) | train | f322c1f000098609f61c5f9cac236537d0b232a9664737e25004a615f8f4c43a | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:e95335d99af822c5d343f9a88c23c529c7627dca123ac0d13f0da13743177049 | dili:cb323b9f1c7dd04805b87ba450736683b22e79809056020d5364181aa974bac0 | dili:e95335d99af822c5d343f9a88c23c529c7627dca123ac0d13f0da13743177049 | dili:cb323b9f1c7dd04805b87ba450736683b22e79809056020d5364181aa974bac0 | VFNGKCDDZUSWLR-UHFFFAOYSA-N | KPSRODZRAIWAKH-UHFFFAOYSA-N | O=S(=O)(O)OS(=O)(=O)O | CC(C)(Oc1ccc(C2CC2(Cl)Cl)cc1)C(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo bile-collection study; Sprague-Dawley rats (n=3-4 experiments). Intact animal, intrinsically metabolically competent per protocol.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow... | [
"assay_format=in_vivo_animal",
"biological_system_context=Wild-type and Pparα(-/-) SV129 mice, in vivo bile collection (n=7-10 per group); intrinsically metabolically competent in vivo system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rat... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 14.9 | 30.3 | 15.4 | 9.325017 | {
"nontransfer": 0.999996327797639,
"transfer": 0.000003672202360991096
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 15.4 | 1.651472 | 0.000004 | 9.325017 | 0.000004 | 0.999996 | safety_canonical_v27 | 0 | true | 0.075 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | VFNGKCDDZUSWLR-UHFFFAOYSA-N | KPSRODZRAIWAKH-UHFFFAOYSA-N | parent:VFNGKCDDZUSWLR-UHFFFAOYSA-N | c1ccc(C2CC2)cc1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "14.9",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 14.9,
"aggregate_max": 14.9,
"aggregate_q1": 14.9,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "30.3",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 30.3,
"aggregate_max": 30.3,
"aggregate_q1": 30.3,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo bile-collection study; Sprague-Dawley rats (n=3-4 experiments). Intact animal, intrinsically metabolically competent per protocol.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_directio... | {"assay_format":"in_vivo_animal","biological_system_context":"Wild-type and Ppar\u03b1(-/-) SV129 mice, in vivo bile collection (n=7-10 per group); intrinsically metabolically competent in vivo system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_directi... | L4 | gold_v1 | sr_654bdd09cb604a5fb88584a399179675 | sr_38ddc4a129ed4f1d9623f10dbfa65e9f | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: In vivo mal... | (B) | train | cfc0b744a1a14605bb5f61c715902f8b91f07f53efa3957cf6b80c8e4c4c4877 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:28e81598a8658dbfe44abd0947b0be027f1e3ca32001c70ed954b8522ee722ea | dili:ae3f62ea784940a5875c7864839486fee1f002880101a68f8ab7cefa8e9e86a6 | dili:28e81598a8658dbfe44abd0947b0be027f1e3ca32001c70ed954b8522ee722ea | dili:ae3f62ea784940a5875c7864839486fee1f002880101a68f8ab7cefa8e9e86a6 | YPHMISFOHDHNIV-FSZOTQKASA-N | DKPMWHFRUGMUKF-CRKPLTDNSA-N | C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1 | C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_me... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 5.38 | 18.85 | 13.47 | 9.325017 | {
"nontransfer": 0.9999709078757324,
"transfer": 0.000029092124267596154
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 13.47 | 1.444501 | 0.000029 | 9.325017 | 0.000029 | 0.999971 | safety_canonical_v27 | 0 | true | 0.15942 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | YPHMISFOHDHNIV-FSZOTQKASA-N | DKPMWHFRUGMUKF-CRKPLTDNSA-N | O=C1CC(CCC2CCCCC2=O)CC(=O)N1 | C1CCC2C(C1)CCC1C3CCCC3CCC21 | {
"aggregation_method": "individual_record",
"display_measurement_text": "5.38",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 5.38,
"aggregate_max": 5.38,
"aggregate_q1": 5.38,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "18.85",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 18.85,
"aggregate_max": 18.85,
"aggregate_q1": 18.85,... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"increase","endpoint_metric":"bile flow rate","end... | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"... | L4 | gold_v1 | sr_8a4af9c65db445db8f03d24a765dbc72 | sr_e0dd87d38fae4210ae54dbe4c0107f6b | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus) in viv... | (B) | train | 2838ac1048c4b6775c2e847cce4aa7728cceff5b78d2eaafd7afdecfb900a88b | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:23fce8cdc1a3034e8a61beb7be05f27ce53664c8a613c384a1f4826b287a3b1e | dili:182e1713eb9965d45677af92b3e9f1e05f2bd9cce55eea95950a5c4623b57081 | dili:23fce8cdc1a3034e8a61beb7be05f27ce53664c8a613c384a1f4826b287a3b1e | dili:182e1713eb9965d45677af92b3e9f1e05f2bd9cce55eea95950a5c4623b57081 | GHCZAUBVMUEKKP-XROMFQGDSA-N | MECYMOKOKLARJV-PCNQZJBLSA-N | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rats, in vivo bile-collection experiment",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate at Tm",
"endpoint_name=biliary_secretion_or_bile_flow",
"exposure_conditions=Glycoursode... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 15.45 | 0.27 | 15.18 | 5.5845 | {
"nontransfer": 0.9999999999144893,
"transfer": 8.551069004750297e-11
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 15.18 | 2.718238 | 0 | 5.5845 | 0 | 1 | safety_canonical_v27 | 0 | true | 0.4375 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | GHCZAUBVMUEKKP-XROMFQGDSA-N | MECYMOKOKLARJV-PCNQZJBLSA-N | C1CCC2C(C1)CCC1C3CCCC3CCC21 | C1=C2CCCCC2C2CCC3CCCC3C2C1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "15.45",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 15.45,
"aggregate_max": 15.45,
"aggregate... | {
"aggregation_method": "individual_record",
"display_measurement_text": "0.27",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 0.27,
"aggregate_max": 0.27,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rats, in vivo bile-collection experiment","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"present","endpoint_metric":"bile flow rate at Tm","endpoint_name":"biliary_secretion_or_bile_... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"decrea... | L4 | gold_v1 | sr_e6b4d77b904f460995dbf02ba8653c2b | sr_5916d18874cd46a487a6aef7541223af | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>NCCC(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rattus norvegicus, in vivo bile collection, bile-salt-free isotope studies, β-alanine pretreated r... | (B) | train | 60bbcbe5090de997d5304fbb7d8d97adec2813a4f03c60acc579ad9fb56fc41b | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:6323cf83ec5257a8d7a665b401a4d2b0196c3c6a4cd48ff522e6c5d597c4a644 | dili:5efdf6a9f460b4828ceaf1c93eb1b3a761f982e94766e34784424d001483ec37 | dili:6323cf83ec5257a8d7a665b401a4d2b0196c3c6a4cd48ff522e6c5d597c4a644 | dili:5efdf6a9f460b4828ceaf1c93eb1b3a761f982e94766e34784424d001483ec37 | MUBZPKHOEPUJKR-UHFFFAOYSA-N | UCMIRNVEIXFBKS-UHFFFAOYSA-N | O=C(O)C(=O)O | NCCC(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rattus norvegicus, in vivo bile collection, bile-salt-free isotope studies, β-alanine pretreated rats versus control rats",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoi... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 1.87 | 21.95 | 20.08 | 5.5845 | {
"nontransfer": 0.9999999999999868,
"transfer": 1.3225023223695538e-14
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 20.08 | 3.595667 | 0 | 5.5845 | 0 | 1 | safety_canonical_v27 | 0 | true | 0.266667 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | MUBZPKHOEPUJKR-UHFFFAOYSA-N | UCMIRNVEIXFBKS-UHFFFAOYSA-N | parent:MUBZPKHOEPUJKR-UHFFFAOYSA-N | parent:UCMIRNVEIXFBKS-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "1.87",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 1.87,
"aggregate_max": 1.87,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "21.95",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 21.95,
"aggregate_max": 21.95,
"aggregate... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"decrea... | {"assay_format":"in_vivo_animal","biological_system_context":"Rattus norvegicus, in vivo bile collection, bile-salt-free isotope studies, \u03b2-alanine pretreated rats versus control rats","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.8,"effect_direction":"increase... | L4 | gold_v1 | sr_d600728bdfb849beb6d6bda1d35afcf8 | sr_a1ac8787621642a595cf64eb57aa3bf9 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Male rats (Rattus norvegicus), in vivo, timed bil... | (B) | train | 7d9011cf4aeffb2040f70e44ad97a4e8f34c415fdb88a025f068f54b293cdae1 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:ae3f62ea784940a5875c7864839486fee1f002880101a68f8ab7cefa8e9e86a6 | dili:28e81598a8658dbfe44abd0947b0be027f1e3ca32001c70ed954b8522ee722ea | dili:ae3f62ea784940a5875c7864839486fee1f002880101a68f8ab7cefa8e9e86a6 | dili:28e81598a8658dbfe44abd0947b0be027f1e3ca32001c70ed954b8522ee722ea | DKPMWHFRUGMUKF-CRKPLTDNSA-N | YPHMISFOHDHNIV-FSZOTQKASA-N | C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_me... | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 18.85 | 5.38 | 13.47 | 9.325017 | {
"nontransfer": 0.9999709078757324,
"transfer": 0.000029092124267596154
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 13.47 | 1.444501 | 0.000029 | 9.325017 | 0.000029 | 0.999971 | safety_canonical_v27 | 0 | true | 0.15942 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | DKPMWHFRUGMUKF-CRKPLTDNSA-N | YPHMISFOHDHNIV-FSZOTQKASA-N | C1CCC2C(C1)CCC1C3CCCC3CCC21 | O=C1CC(CCC2CCCCC2=O)CC(=O)N1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "18.85",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 18.85,
"aggregate_max": 18.85,
"aggregate_q1": 18.85,... | {
"aggregation_method": "individual_record",
"display_measurement_text": "5.38",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 5.38,
"aggregate_max": 5.38,
"aggregate_q1": 5.38,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"... | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"increase","endpoint_metric":"bile flow rate","end... | L4 | gold_v1 | sr_e0dd87d38fae4210ae54dbe4c0107f6b | sr_8a4af9c65db445db8f03d24a765dbc72 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CCC1(c2ccccc2)C(=O)NC(=O)NC1=O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in... | (A) | train | 55099612e77f7d987433fd3cfbd838a2b30de0937aaf02ab09b1db2347ebc42e | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:51532c46b483b0f9a8d73b49375551eea075129f5de34ea06c719c95ac522f90 | dili:12ac9f43e5181b1a9d82fe21da0fb6145b6d579a65d1f315991994d183a60977 | dili:51532c46b483b0f9a8d73b49375551eea075129f5de34ea06c719c95ac522f90 | dili:12ac9f43e5181b1a9d82fe21da0fb6145b6d579a65d1f315991994d183a60977 | SGIWFELWJPNFDH-UHFFFAOYSA-N | DDBREPKUVSBGFI-UHFFFAOYSA-N | O=S(=O)(c1ccccc1)N(CC(F)(F)F)c1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1 | CCC1(c2ccccc2)C(=O)NC(=O)NC1=O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Male C57BL/6J mice, 2-3 months old, in vivo; metabolic competence: intact in vivo (intrinsically competent)",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliar... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile-acid-independent ... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 7.8 | 6.61 | 1.19 | 5.5845 | {
"nontransfer": 0.13364566452300097,
"transfer": 0.866354335476999
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 1.19 | 0.21309 | 0.866354 | 5.5845 | 0.866354 | 0.133646 | safety_canonical_v27 | 1 | true | 0.148148 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | SGIWFELWJPNFDH-UHFFFAOYSA-N | DDBREPKUVSBGFI-UHFFFAOYSA-N | O=S(=O)(Nc1ccccc1)c1ccccc1 | O=C1NC(=O)C(c2ccccc2)C(=O)N1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.8",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.8,
"aggregate_max": 7.8,
"aggregate_q1": ... | {
"aggregation_method": "individual_record",
"display_measurement_text": "6.61",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 6.61,
"aggregate_max": 6.61,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Male C57BL/6J mice, 2-3 months old, in vivo; metabolic competence: intact in vivo (intrinsically competent)","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"no_change","endpoint_metric... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase"... | L4 | gold_v1 | sr_6140b053a4284068ba3638c97504989b | sr_5f1a4bc38132448192f150870527230c | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>NCCC(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus), in vivo, bile-collection model; β-alanine-pretreated (taurine depletion) ... | (B) | train | 350635d60a809c296dc351beb90476c9bad697e60107a35ff5a95fe04a840412 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:40647c681f6bc3cab99cb8a92b684c56c05243b67622d3ed853b6b394ef58693 | dili:79711e38deb67325affb51896f2dc6386c59f0b9d653e2b0daa75e2c463fcbf4 | dili:40647c681f6bc3cab99cb8a92b684c56c05243b67622d3ed853b6b394ef58693 | dili:79711e38deb67325affb51896f2dc6386c59f0b9d653e2b0daa75e2c463fcbf4 | GGLZPLKKBSSKCX-YFKPBYRVSA-N | UCMIRNVEIXFBKS-UHFFFAOYSA-N | CCSCC[C@H](N)C(=O)O | NCCC(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus), in vivo, bile-collection model; β-alanine-pretreated (taurine depletion) rats coinfused TCDC+UDC (group F); intact metabolic competence.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"en... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 4.11 | 18.27 | 14.16 | 9.325017 | {
"nontransfer": 0.9999861187686012,
"transfer": 0.000013881231398774216
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 14.16 | 1.518496 | 0.000014 | 9.325017 | 0.000014 | 0.999986 | safety_canonical_v27 | 0 | true | 0.2 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | GGLZPLKKBSSKCX-YFKPBYRVSA-N | UCMIRNVEIXFBKS-UHFFFAOYSA-N | parent:GGLZPLKKBSSKCX-YFKPBYRVSA-N | parent:UCMIRNVEIXFBKS-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.11",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.11,
"aggregate_max": 4.11,
"aggregate_q1": 4.11,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "18.27",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 18.27,
"aggregate_max": 18.27,
"aggregate_q1": 18.27,... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"increase","endpoint_metric":"bile flow rate","end... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus), in vivo, bile-collection model; \u03b2-alanine-pretreated (taurine depletion) rats coinfused TCDC+UDC (group F); intact metabolic competence.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","conf... | L4 | gold_v1 | sr_3e35e9025cd54d798701ec3ad7e71a9a | sr_c369c3f6667e4396b11581e21f34079e | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rats, in viv... | (B) | train | 7a8fedd3946b34a8083e87508716d83bbbf3d4fdc781a3886a03c45b3ca263b3 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:182e1713eb9965d45677af92b3e9f1e05f2bd9cce55eea95950a5c4623b57081 | dili:23fce8cdc1a3034e8a61beb7be05f27ce53664c8a613c384a1f4826b287a3b1e | dili:182e1713eb9965d45677af92b3e9f1e05f2bd9cce55eea95950a5c4623b57081 | dili:23fce8cdc1a3034e8a61beb7be05f27ce53664c8a613c384a1f4826b287a3b1e | MECYMOKOKLARJV-PCNQZJBLSA-N | GHCZAUBVMUEKKP-XROMFQGDSA-N | C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rats, in vivo bile-collection experiment",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate at Tm",
"endpoint_name=biliary_secretion_or_bile_flow",
"exposure_conditions=Glycoursode... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 0.27 | 15.45 | 15.18 | 5.5845 | {
"nontransfer": 0.9999999999144893,
"transfer": 8.551069004750297e-11
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 15.18 | 2.718238 | 0 | 5.5845 | 0 | 1 | safety_canonical_v27 | 0 | true | 0.4375 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | MECYMOKOKLARJV-PCNQZJBLSA-N | GHCZAUBVMUEKKP-XROMFQGDSA-N | C1=C2CCCCC2C2CCC3CCCC3C2C1 | C1CCC2C(C1)CCC1C3CCCC3CCC21 | {
"aggregation_method": "individual_record",
"display_measurement_text": "0.27",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 0.27,
"aggregate_max": 0.27,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "15.45",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 15.45,
"aggregate_max": 15.45,
"aggregate... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"decrea... | {"assay_format":"in_vivo_animal","biological_system_context":"Rats, in vivo bile-collection experiment","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"present","endpoint_metric":"bile flow rate at Tm","endpoint_name":"biliary_secretion_or_bile_... | L4 | gold_v1 | sr_5916d18874cd46a487a6aef7541223af | sr_e6b4d77b904f460995dbf02ba8653c2b | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>O=S(=O)(c1ccccc1)N(CC(F)(F)F)c1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Male C57BL/6J mice, 2-3 months old, in vivo; m... | (B) | train | 4997f4f9f645d8328331324918b8b8cedb6ca980744e0278a919782e32b87474 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:195ed61e8d1b0d5d2fb70b4161c368883e749a947146c6b81a4a5bc207d81eb0 | dili:51532c46b483b0f9a8d73b49375551eea075129f5de34ea06c719c95ac522f90 | dili:195ed61e8d1b0d5d2fb70b4161c368883e749a947146c6b81a4a5bc207d81eb0 | dili:51532c46b483b0f9a8d73b49375551eea075129f5de34ea06c719c95ac522f90 | DDBREPKUVSBGFI-UHFFFAOYSA-N | SGIWFELWJPNFDH-UHFFFAOYSA-N | CCC1(c2ccccc2)C(=O)NC(=O)NC1=O | O=S(=O)(c1ccccc1)N(CC(F)(F)F)c1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo; individual animals (n up to 10) with bile collected after phenobarbital treatment; values are mean ± SEM.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow... | [
"assay_format=in_vivo_animal",
"biological_system_context=Male C57BL/6J mice, 2-3 months old, in vivo; metabolic competence: intact in vivo (intrinsically competent)",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliar... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 13.8 | 7.8 | 6 | 5.5845 | {
"nontransfer": 0.998823487598636,
"transfer": 0.0011765124013639716
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 6 | 1.074402 | 0.001177 | 5.5845 | 0.001177 | 0.998823 | safety_canonical_v27 | 0 | true | 0.148148 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | DDBREPKUVSBGFI-UHFFFAOYSA-N | SGIWFELWJPNFDH-UHFFFAOYSA-N | O=C1NC(=O)C(c2ccccc2)C(=O)N1 | O=S(=O)(Nc1ccccc1)c1ccccc1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "13.8",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 13.8,
"aggregate_max": 13.8,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.8",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.8,
"aggregate_max": 7.8,
"aggregate_q1": ... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo; individual animals (n up to 10) with bile collected after phenobarbital treatment; values are mean \u00b1 SEM.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_dir... | {"assay_format":"in_vivo_animal","biological_system_context":"Male C57BL/6J mice, 2-3 months old, in vivo; metabolic competence: intact in vivo (intrinsically competent)","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"no_change","endpoint_metric... | L4 | gold_v1 | sr_3c302991f01a4f06aa29a4a28d2a5407 | sr_6140b053a4284068ba3638c97504989b | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CC(C)(C)C(C)(C)Cc1ccc(OCCO)c(Cc2cc(CC(C)(C)C(C)(C)C)cc(Cc3cc(CC(C)(C)C(C)(C)C)ccc3OCCO)c2OCCO)c1</SMILES>
- Assay format: in_vivo_animal
- Biological system context: In vivo rat... | (A) | train | 8e69527e7c1be6ccf3ffcb9fcaaa8609fe94ac6c648036d1fa9a84d68c5db6c0 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:e95b60eec6736d3b87d0d1a110d065283935c315862ab97eab1215d5ccceb86f | dili:daef7ee17eae0383aec6c740eb0c3ca773f85a7d3cd050a9db2bd665421fa71d | dili:e95b60eec6736d3b87d0d1a110d065283935c315862ab97eab1215d5ccceb86f | dili:daef7ee17eae0383aec6c740eb0c3ca773f85a7d3cd050a9db2bd665421fa71d | XOAAWQZATWQOTB-UHFFFAOYSA-N | OCZNOKJDQKWBTM-UHFFFAOYSA-N | NCCS(=O)(=O)O | CC(C)(C)C(C)(C)Cc1ccc(OCCO)c(Cc2cc(CC(C)(C)C(C)(C)C)cc(Cc3cc(CC(C)(C)C(C)(C)C)ccc3OCCO)c2OCCO)c1 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=APAP-treated hamsters (Mesocricetus auratus), in vivo, three to six animals per group; intact in vivo system, intrinsically metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric... | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo rat (Rattus norvegicus) liver; six animals per group; intact in vivo system (intrinsically metabolically competent).",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=basal bile flow rate",
... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 7.72 | 7.8 | 0.08 | 5.5845 | {
"nontransfer": 0.020699148178055293,
"transfer": 0.9793008518219447
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 0.08 | 0.014325 | 0.979301 | 5.5845 | 0.979301 | 0.020699 | safety_canonical_v27 | 1 | true | 0.039216 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | XOAAWQZATWQOTB-UHFFFAOYSA-N | OCZNOKJDQKWBTM-UHFFFAOYSA-N | parent:XOAAWQZATWQOTB-UHFFFAOYSA-N | c1ccc(Cc2cccc(Cc3ccccc3)c2)cc1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.72",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.72,
"aggregate_max": 7.72,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.8",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.8,
"aggregate_max": 7.8,
"aggregate_q1": ... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"APAP-treated hamsters (Mesocricetus auratus), in vivo, three to six animals per group; intact in vivo system, intrinsically metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.75,"effe... | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo rat (Rattus norvegicus) liver; six animals per group; intact in vivo system (intrinsically metabolically competent).","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.8,"effect_direction":"increase",... | L4 | gold_v1 | sr_dd3de8c090584b9d9289080b8289b1a5 | sr_153eb54cece64d7bbc5ec955a7f8f309 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>NCCS(=O)(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: APAP-treated hamsters (Mesocricetus auratus), in vivo, three to six animals per group; intact ... | (B) | train | 72cc1c47623580ffc9bdeaad3f3e5640e2670cf0f9709851205b0161a59f9eca | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:642f46db98fcfefd64b860bfa2d29ab4e81b49349142e96c276dc0184d6017ef | dili:e95b60eec6736d3b87d0d1a110d065283935c315862ab97eab1215d5ccceb86f | dili:642f46db98fcfefd64b860bfa2d29ab4e81b49349142e96c276dc0184d6017ef | dili:e95b60eec6736d3b87d0d1a110d065283935c315862ab97eab1215d5ccceb86f | DNIAPMSPPWPWGF-UHFFFAOYSA-N | XOAAWQZATWQOTB-UHFFFAOYSA-N | CC(O)CO | NCCS(=O)(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile-acid-independent ... | [
"assay_format=in_vivo_animal",
"biological_system_context=APAP-treated hamsters (Mesocricetus auratus), in vivo, three to six animals per group; intact in vivo system, intrinsically metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 4.79 | 7.72 | 2.93 | 5.5845 | {
"nontransfer": 0.7767219985693794,
"transfer": 0.22327800143062063
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 2.93 | 0.524666 | 0.223278 | 5.5845 | 0.223278 | 0.776722 | safety_canonical_v27 | 0 | true | 0.090909 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | DNIAPMSPPWPWGF-UHFFFAOYSA-N | XOAAWQZATWQOTB-UHFFFAOYSA-N | parent:DNIAPMSPPWPWGF-UHFFFAOYSA-N | parent:XOAAWQZATWQOTB-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.79",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.79,
"aggregate_max": 4.79,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.72",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.72,
"aggregate_max": 7.72,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"no_change... | {"assay_format":"in_vivo_animal","biological_system_context":"APAP-treated hamsters (Mesocricetus auratus), in vivo, three to six animals per group; intact in vivo system, intrinsically metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.75,"effe... | L4 | gold_v1 | sr_b051effdb7c548f7ac1a6aa1a01994a4 | sr_dd3de8c090584b9d9289080b8289b1a5 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: In vivo bil... | (B) | train | 14f3412657f33a375a32bb306807784ba3030efedc43d2e7e905e69f9007e297 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:32689c2b57e4228d1a9519ea72deb8452513798897810c8dd6f15cfefe32a277 | dili:32e00f1154dbb58ce37df0104fe3b80ee3378363957e182b93c27559330908f4 | dili:32689c2b57e4228d1a9519ea72deb8452513798897810c8dd6f15cfefe32a277 | dili:32e00f1154dbb58ce37df0104fe3b80ee3378363957e182b93c27559330908f4 | YPHMISFOHDHNIV-FSZOTQKASA-N | DKPMWHFRUGMUKF-CRKPLTDNSA-N | C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1 | C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo bile-collection study; Sprague-Dawley rats (n=3-4 experiments). Intact animal, intrinsically metabolically competent per protocol.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 4.06 | 13 | 8.94 | 9.325017 | {
"nontransfer": 0.9962681559150683,
"transfer": 0.003731844084931647
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 8.94 | 0.958711 | 0.003732 | 9.325017 | 0.003732 | 0.996268 | safety_canonical_v27 | 0 | true | 0.15942 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | YPHMISFOHDHNIV-FSZOTQKASA-N | DKPMWHFRUGMUKF-CRKPLTDNSA-N | O=C1CC(CCC2CCCCC2=O)CC(=O)N1 | C1CCC2C(C1)CCC1C3CCCC3CCC21 | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.06",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.06,
"aggregate_max": 4.06,
"aggregate_q1": 4.06,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "13",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 13,
"aggregate_max": 13,
"aggregate_q1": 13,
"aggregat... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase","endpoint_metric":"bile flow rate","endp... | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo bile-collection study; Sprague-Dawley rats (n=3-4 experiments). Intact animal, intrinsically metabolically competent per protocol.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_directio... | L4 | gold_v1 | sr_d2a6f3c9e2c444fd94496ea3fdd30f9e | sr_94f588ab3baa4327a97d1d188f52e534 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rats, in viv... | (B) | train | eada6358a1418801acc83da0c999a4ac21cf673cf3bb9f589b5a973032cdac08 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:3b7fbe8e584b862aef792235b051e8922b1d110d451c2852bf679ea6aeb04779 | dili:23fce8cdc1a3034e8a61beb7be05f27ce53664c8a613c384a1f4826b287a3b1e | dili:3b7fbe8e584b862aef792235b051e8922b1d110d451c2852bf679ea6aeb04779 | dili:23fce8cdc1a3034e8a61beb7be05f27ce53664c8a613c384a1f4826b287a3b1e | MUBZPKHOEPUJKR-UHFFFAOYSA-N | GHCZAUBVMUEKKP-XROMFQGDSA-N | O=C(O)C(=O)O | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo with biliary collection; co-infused bile salts given intravenously; metabolically competent intact system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rats, in vivo bile-collection experiment",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate at Tm",
"endpoint_name=biliary_secretion_or_bile_flow",
"exposure_conditions=Glycoursode... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 8.57 | 15.45 | 6.88 | 5.5845 | {
"nontransfer": 0.9997564181041505,
"transfer": 0.00024358189584953958
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 6.88 | 1.231981 | 0.000244 | 5.5845 | 0.000244 | 0.999756 | safety_canonical_v27 | 0 | true | 0.072727 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | MUBZPKHOEPUJKR-UHFFFAOYSA-N | GHCZAUBVMUEKKP-XROMFQGDSA-N | parent:MUBZPKHOEPUJKR-UHFFFAOYSA-N | C1CCC2C(C1)CCC1C3CCCC3CCC21 | {
"aggregation_method": "individual_record",
"display_measurement_text": "8.57",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 8.57,
"aggregate_max": 8.57,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "15.45",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 15.45,
"aggregate_max": 15.45,
"aggregate... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo with biliary collection; co-infused bile salts given intravenously; metabolically competent intact system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_directi... | {"assay_format":"in_vivo_animal","biological_system_context":"Rats, in vivo bile-collection experiment","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"present","endpoint_metric":"bile flow rate at Tm","endpoint_name":"biliary_secretion_or_bile_... | L4 | gold_v1 | sr_1e5923f03ece45689f88a1bd7f47a771 | sr_e6b4d77b904f460995dbf02ba8653c2b | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CCC1(c2ccccc2)C(=O)NC(=O)NC1=O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus) in vivo; individual animals (n up to 10) with bile co... | (B) | train | 1df6dabeb840a7becda9799a88d24ad86805a8c94bd4cb00ec31c7c4e43cec09 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:6293265c0525f91cec51f01a12c2c59d8c90200c1337eedfb51a47c8937bb65d | dili:195ed61e8d1b0d5d2fb70b4161c368883e749a947146c6b81a4a5bc207d81eb0 | dili:6293265c0525f91cec51f01a12c2c59d8c90200c1337eedfb51a47c8937bb65d | dili:195ed61e8d1b0d5d2fb70b4161c368883e749a947146c6b81a4a5bc207d81eb0 | XAGFODPZIPBFFR-UHFFFAOYSA-N | DDBREPKUVSBGFI-UHFFFAOYSA-N | [Al] | CCC1(c2ccccc2)C(=O)NC(=O)NC1=O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Adult rats (Rattus norvegicus), in vivo, intact organism; Al-intoxication model; bile flow collected under basal conditions.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"end... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo; individual animals (n up to 10) with bile collected after phenobarbital treatment; values are mean ± SEM.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 4.25 | 13.8 | 9.55 | 5.5845 | {
"nontransfer": 0.9999979566220867,
"transfer": 0.0000020433779133518643
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 9.55 | 1.71009 | 0.000002 | 5.5845 | 0.000002 | 0.999998 | safety_canonical_v27 | 0 | true | 0 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | XAGFODPZIPBFFR-UHFFFAOYSA-N | DDBREPKUVSBGFI-UHFFFAOYSA-N | parent:XAGFODPZIPBFFR-UHFFFAOYSA-N | O=C1NC(=O)C(c2ccccc2)C(=O)N1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.25",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.25,
"aggregate_max": 4.25,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "13.8",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 13.8,
"aggregate_max": 13.8,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Adult rats (Rattus norvegicus), in vivo, intact organism; Al-intoxication model; bile flow collected under basal conditions.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"decrease",... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo; individual animals (n up to 10) with bile collected after phenobarbital treatment; values are mean \u00b1 SEM.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_dir... | L4 | gold_v1 | sr_5829e25f0c084de3a9890aecb7e138c8 | sr_3c302991f01a4f06aa29a4a28d2a5407 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>COc1cc2c(c(OC)c1OC)-c1ccc(OC)c(=O)cc1[C@@H](NC(C)=O)CC2</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rattus norvegicus (rat), intact in vivo system (meta... | (A) | train | 45b8912c2d66ffb5be695f36b1bd98759272bede78a58b69045038a0b755e280 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:12ac9f43e5181b1a9d82fe21da0fb6145b6d579a65d1f315991994d183a60977 | dili:92e4e559cb6021ffa17757dbd3d0e5a6057fed83c2a26fdc5930ba6ef0a55876 | dili:12ac9f43e5181b1a9d82fe21da0fb6145b6d579a65d1f315991994d183a60977 | dili:92e4e559cb6021ffa17757dbd3d0e5a6057fed83c2a26fdc5930ba6ef0a55876 | DDBREPKUVSBGFI-UHFFFAOYSA-N | IAKHMKGGTNLKSZ-INIZCTEOSA-N | CCC1(c2ccccc2)C(=O)NC(=O)NC1=O | COc1cc2c(c(OC)c1OC)-c1ccc(OC)c(=O)cc1[C@@H](NC(C)=O)CC2 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile-acid-independent ... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rattus norvegicus (rat), intact in vivo system (metabolically competent), colchicine-treated for 8 hr; bile collected and measured.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 6.61 | 7.4 | 0.79 | 5.5845 | {
"nontransfer": 0.07008592334685404,
"transfer": 0.929914076653146
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 0.79 | 0.141463 | 0.929914 | 5.5845 | 0.929914 | 0.070086 | safety_canonical_v27 | 1 | true | 0.106061 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | DDBREPKUVSBGFI-UHFFFAOYSA-N | IAKHMKGGTNLKSZ-INIZCTEOSA-N | O=C1NC(=O)C(c2ccccc2)C(=O)N1 | O=c1cccc2c(c1)CCCc1ccccc1-2 | {
"aggregation_method": "individual_record",
"display_measurement_text": "6.61",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 6.61,
"aggregate_max": 6.61,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.4",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.4,
"aggregate_max": 7.4,
"aggregate_q1": ... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase"... | {"assay_format":"in_vivo_animal","biological_system_context":"Rattus norvegicus (rat), intact in vivo system (metabolically competent), colchicine-treated for 8 hr; bile collected and measured.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"dec... | L4 | gold_v1 | sr_5f1a4bc38132448192f150870527230c | sr_91bbdf701b3d4cbfa8023dcfc56fb2e7 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3C(=O)C[C@@]21C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus) in vi... | (A) | train | b8b5de658c5fd58f9d1495295573756f6e238fc5961302f2901395dcba52899d | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:fdc0a5f33f0b9fee0aedc74bd2f7b99068b88362c0f38190e05bfc81aac2472a | dili:9dee46f49be1a7877c963e10dba295f26374aca2325f2e47d0dd418452eb56b3 | dili:fdc0a5f33f0b9fee0aedc74bd2f7b99068b88362c0f38190e05bfc81aac2472a | dili:9dee46f49be1a7877c963e10dba295f26374aca2325f2e47d0dd418452eb56b3 | XAGFODPZIPBFFR-UHFFFAOYSA-N | ITRJWOMZKQRYTA-RFZYENFJSA-N | [Al] | CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3C(=O)C[C@@]21C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rattus norvegicus rats, chronic Al-intoxication model, in vivo basal bile collection, n=6; intrinsically metabolically competent in vivo system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bil... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile-acid-independent ... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 4.25 | 4.43 | 0.18 | 5.5845 | {
"nontransfer": 0.024658180264758744,
"transfer": 0.9753418197352413
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 0.18 | 0.032232 | 0.975342 | 5.5845 | 0.975342 | 0.024658 | safety_canonical_v27 | 1 | true | 0 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | XAGFODPZIPBFFR-UHFFFAOYSA-N | ITRJWOMZKQRYTA-RFZYENFJSA-N | parent:XAGFODPZIPBFFR-UHFFFAOYSA-N | O=C1C=C2CCC3C4CCCC4CC(=O)C3C2CC1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.25",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.25,
"aggregate_max": 4.25,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.43",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.43,
"aggregate_max": 4.43,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rattus norvegicus rats, chronic Al-intoxication model, in vivo basal bile collection, n=6; intrinsically metabolically competent in vivo system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.88,"effect_d... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"no_change... | L4 | gold_v1 | sr_1447743d61614aa7b100609c04fb224c | sr_52188b0589eb43ada64e7fab1b5bd593 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rats, in viv... | (B) | train | 1737dc428ebbe6006ffe2c5cee410d672177b01a8532305a0a1f38dd6a7af51d | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:5efdf6a9f460b4828ceaf1c93eb1b3a761f982e94766e34784424d001483ec37 | dili:23fce8cdc1a3034e8a61beb7be05f27ce53664c8a613c384a1f4826b287a3b1e | dili:5efdf6a9f460b4828ceaf1c93eb1b3a761f982e94766e34784424d001483ec37 | dili:23fce8cdc1a3034e8a61beb7be05f27ce53664c8a613c384a1f4826b287a3b1e | UCMIRNVEIXFBKS-UHFFFAOYSA-N | GHCZAUBVMUEKKP-XROMFQGDSA-N | NCCC(=O)O | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rattus norvegicus, in vivo bile collection, bile-salt-free isotope studies, β-alanine pretreated rats versus control rats",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoi... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rats, in vivo bile-collection experiment",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate at Tm",
"endpoint_name=biliary_secretion_or_bile_flow",
"exposure_conditions=Glycoursode... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 21.95 | 15.45 | 6.5 | 5.5845 | {
"nontransfer": 0.9995190945733332,
"transfer": 0.00048090542666682183
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 6.5 | 1.163936 | 0.000481 | 5.5845 | 0.000481 | 0.999519 | safety_canonical_v27 | 0 | true | 0.118644 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | UCMIRNVEIXFBKS-UHFFFAOYSA-N | GHCZAUBVMUEKKP-XROMFQGDSA-N | parent:UCMIRNVEIXFBKS-UHFFFAOYSA-N | C1CCC2C(C1)CCC1C3CCCC3CCC21 | {
"aggregation_method": "individual_record",
"display_measurement_text": "21.95",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 21.95,
"aggregate_max": 21.95,
"aggregate... | {
"aggregation_method": "individual_record",
"display_measurement_text": "15.45",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 15.45,
"aggregate_max": 15.45,
"aggregate... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rattus norvegicus, in vivo bile collection, bile-salt-free isotope studies, \u03b2-alanine pretreated rats versus control rats","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.8,"effect_direction":"increase... | {"assay_format":"in_vivo_animal","biological_system_context":"Rats, in vivo bile-collection experiment","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"present","endpoint_metric":"bile flow rate at Tm","endpoint_name":"biliary_secretion_or_bile_... | L4 | gold_v1 | sr_a1ac8787621642a595cf64eb57aa3bf9 | sr_e6b4d77b904f460995dbf02ba8653c2b | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3C(=O)C[C@@]21C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus) in vi... | (A) | train | d31073308cc2da701315126fa61c7d52836ea9b7739ba1c707b8c2880ccb6b19 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:9efa179c73816a18f1a7e820124cab39565b7cf7e91fee502d68e5fed1f83075 | dili:9dee46f49be1a7877c963e10dba295f26374aca2325f2e47d0dd418452eb56b3 | dili:9efa179c73816a18f1a7e820124cab39565b7cf7e91fee502d68e5fed1f83075 | dili:9dee46f49be1a7877c963e10dba295f26374aca2325f2e47d0dd418452eb56b3 | GVJHHUAWPYXKBD-IEOSBIPESA-N | ITRJWOMZKQRYTA-RFZYENFJSA-N | Cc1c(C)c2c(c(C)c1O)CC[C@@](C)(CCC[C@H](C)CCC[C@H](C)CCCC(C)C)O2 | CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3C(=O)C[C@@]21C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rattus norvegicus rats, chronic Al-intoxication model with Vit E coadministration, in vivo basal bile collection, n=6.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile-acid-independent ... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 6.51 | 4.43 | 2.08 | 5.5845 | {
"nontransfer": 0.4315806227034461,
"transfer": 0.5684193772965539
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 2.08 | 0.372459 | 0.568419 | 5.5845 | 0.568419 | 0.431581 | safety_canonical_v27 | 1 | false | 0.103448 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | GVJHHUAWPYXKBD-IEOSBIPESA-N | ITRJWOMZKQRYTA-RFZYENFJSA-N | c1ccc2c(c1)CCCO2 | O=C1C=C2CCC3C4CCCC4CC(=O)C3C2CC1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "6.51",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 6.51,
"aggregate_max": 6.51,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.43",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.43,
"aggregate_max": 4.43,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rattus norvegicus rats, chronic Al-intoxication model with Vit E coadministration, in vivo basal bile collection, n=6.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.88,"effect_direction":"increase","endp... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"no_change... | L4 | gold_v1 | sr_d19213833dea4a8880e9dfe814d229ea | sr_52188b0589eb43ada64e7fab1b5bd593 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>O=S(=O)(c1ccccc1)N(CC(F)(F)F)c1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Male C57BL/6J mice, 2-3 months old, in vivo; m... | (A) | train | e671880bdbefc32f4055b2b0656013f845293468732b6e41a318d07ffcd605fc | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:daef7ee17eae0383aec6c740eb0c3ca773f85a7d3cd050a9db2bd665421fa71d | dili:51532c46b483b0f9a8d73b49375551eea075129f5de34ea06c719c95ac522f90 | dili:daef7ee17eae0383aec6c740eb0c3ca773f85a7d3cd050a9db2bd665421fa71d | dili:51532c46b483b0f9a8d73b49375551eea075129f5de34ea06c719c95ac522f90 | OCZNOKJDQKWBTM-UHFFFAOYSA-N | SGIWFELWJPNFDH-UHFFFAOYSA-N | CC(C)(C)C(C)(C)Cc1ccc(OCCO)c(Cc2cc(CC(C)(C)C(C)(C)C)cc(Cc3cc(CC(C)(C)C(C)(C)C)ccc3OCCO)c2OCCO)c1 | O=S(=O)(c1ccccc1)N(CC(F)(F)F)c1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo rat (Rattus norvegicus) liver; six animals per group; intact in vivo system (intrinsically metabolically competent).",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=basal bile flow rate",
... | [
"assay_format=in_vivo_animal",
"biological_system_context=Male C57BL/6J mice, 2-3 months old, in vivo; metabolic competence: intact in vivo (intrinsically competent)",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliar... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 7.8 | 7.8 | 0 | 5.5845 | {
"nontransfer": 0.01798620996209155,
"transfer": 0.9820137900379085
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 0 | 0 | 0.982014 | 5.5845 | 0.982014 | 0.017986 | safety_canonical_v27 | 1 | true | 0.085714 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | OCZNOKJDQKWBTM-UHFFFAOYSA-N | SGIWFELWJPNFDH-UHFFFAOYSA-N | c1ccc(Cc2cccc(Cc3ccccc3)c2)cc1 | O=S(=O)(Nc1ccccc1)c1ccccc1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.8",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.8,
"aggregate_max": 7.8,
"aggregate_q1": ... | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.8",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.8,
"aggregate_max": 7.8,
"aggregate_q1": ... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo rat (Rattus norvegicus) liver; six animals per group; intact in vivo system (intrinsically metabolically competent).","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.8,"effect_direction":"increase",... | {"assay_format":"in_vivo_animal","biological_system_context":"Male C57BL/6J mice, 2-3 months old, in vivo; metabolic competence: intact in vivo (intrinsically competent)","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"no_change","endpoint_metric... | L4 | gold_v1 | sr_153eb54cece64d7bbc5ec955a7f8f309 | sr_6140b053a4284068ba3638c97504989b | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CCC1(c2ccccc2)C(=O)NC(=O)NC1=O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus) in vivo; individual animals (n up to 10) with bile co... | (A) | train | e6f45b4fc0d2e8e0b07e7bf71274630ef9f712111c21e7ba08458f8ded8ec226 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:cdc7b538cd367a59ebd7842a083e6e368139d1174b1556a671e84f3136199f86 | dili:195ed61e8d1b0d5d2fb70b4161c368883e749a947146c6b81a4a5bc207d81eb0 | dili:cdc7b538cd367a59ebd7842a083e6e368139d1174b1556a671e84f3136199f86 | dili:195ed61e8d1b0d5d2fb70b4161c368883e749a947146c6b81a4a5bc207d81eb0 | BHTRKEVKTKCXOH-LBSADWJPSA-N | DDBREPKUVSBGFI-UHFFFAOYSA-N | C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | CCC1(c2ccccc2)C(=O)NC(=O)NC1=O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo rat biliary excretion study; species Rattus norvegicus; intact metabolic competence",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate during Tm period",
"endpoint_name=bilia... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo; individual animals (n up to 10) with bile collected after phenobarbital treatment; values are mean ± SEM.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 15.9 | 13.8 | 2.1 | 5.5845 | {
"nontransfer": 0.44038696278160605,
"transfer": 0.559613037218394
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 2.1 | 0.376041 | 0.559613 | 5.5845 | 0.559613 | 0.440387 | safety_canonical_v27 | 1 | false | 0.051282 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | BHTRKEVKTKCXOH-LBSADWJPSA-N | DDBREPKUVSBGFI-UHFFFAOYSA-N | C1CCC2C(C1)CCC1C3CCCC3CCC21 | O=C1NC(=O)C(c2ccccc2)C(=O)N1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "15.9",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 15.9,
"aggregate_max": 15.9,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "13.8",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 13.8,
"aggregate_max": 13.8,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo rat biliary excretion study; species Rattus norvegicus; intact metabolic competence","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"present","endpoint_metric":"bile flow rate ... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo; individual animals (n up to 10) with bile collected after phenobarbital treatment; values are mean \u00b1 SEM.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_dir... | L4 | gold_v1 | sr_9a6596cb8a914ad4871d994a3d52c1f9 | sr_3c302991f01a4f06aa29a4a28d2a5407 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Male rats (Rattus norvegicus), in vivo, timed bil... | (A) | train | 418fb1d0ae910c4bd8563902190cb69fd169fc7a30df2db21060c3e49cc1533c | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:bbe7c9cb57f743e44885a7c45a1fff29fdd54a0470486dac89653fb7d6254e84 | dili:28e81598a8658dbfe44abd0947b0be027f1e3ca32001c70ed954b8522ee722ea | dili:bbe7c9cb57f743e44885a7c45a1fff29fdd54a0470486dac89653fb7d6254e84 | dili:28e81598a8658dbfe44abd0947b0be027f1e3ca32001c70ed954b8522ee722ea | UEEJHVSXFDXPFK-UHFFFAOYSA-N | YPHMISFOHDHNIV-FSZOTQKASA-N | CN(C)CCO | C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Adult male Wistar rats with an external bile fistula and jugular catheter, in vivo; baseline saline infusion to wash out endogenous bile salt pool.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=... | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 2.3 | 5.38 | 3.08 | 9.325017 | {
"nontransfer": 0.332465065030933,
"transfer": 0.667534934969067
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 3.08 | 0.330294 | 0.667535 | 9.325017 | 0.667535 | 0.332465 | safety_canonical_v27 | 1 | true | 0.068182 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | UEEJHVSXFDXPFK-UHFFFAOYSA-N | YPHMISFOHDHNIV-FSZOTQKASA-N | parent:UEEJHVSXFDXPFK-UHFFFAOYSA-N | O=C1CC(CCC2CCCCC2=O)CC(=O)N1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "2.3",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2.3,
"aggregate_max": 2.3,
"aggregate_q1": 2.3,
"aggr... | {
"aggregation_method": "individual_record",
"display_measurement_text": "5.38",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 5.38,
"aggregate_max": 5.38,
"aggregate_q1": 5.38,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Adult male Wistar rats with an external bile fistula and jugular catheter, in vivo; baseline saline infusion to wash out endogenous bile salt pool.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect... | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"increase","endpoint_metric":"bile flow rate","end... | L4 | gold_v1 | sr_e23e2eaa4b19487281e3ca47eec1d24c | sr_8a4af9c65db445db8f03d24a765dbc72 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CC(C)(Oc1ccc(C2CC2(Cl)Cl)cc1)C(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Male wild-type mice (Mus musculus); in vivo bile collection; metabolic c... | (B) | train | b8fb38f98ff7eff8653c63ec3600eccf29cf7dcab673dbff6ed28bf6481e093c | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:79711e38deb67325affb51896f2dc6386c59f0b9d653e2b0daa75e2c463fcbf4 | dili:8130a61e464897b7b951670ffdf271fd0de7852501950e364cec1d6ba39c6910 | dili:79711e38deb67325affb51896f2dc6386c59f0b9d653e2b0daa75e2c463fcbf4 | dili:8130a61e464897b7b951670ffdf271fd0de7852501950e364cec1d6ba39c6910 | UCMIRNVEIXFBKS-UHFFFAOYSA-N | KPSRODZRAIWAKH-UHFFFAOYSA-N | NCCC(=O)O | CC(C)(Oc1ccc(C2CC2(Cl)Cl)cc1)C(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus), in vivo, bile-collection model; β-alanine-pretreated (taurine depletion) rats coinfused TCDC+UDC (group F); intact metabolic competence.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"en... | [
"assay_format=in_vivo_animal",
"biological_system_context=Male wild-type mice (Mus musculus); in vivo bile collection; metabolic competence: intact in vivo system; units per 100 g body weight",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 18.27 | 30.3 | 12.03 | 9.325017 | {
"nontransfer": 0.9998637361019137,
"transfer": 0.00013626389808625298
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 12.03 | 1.290078 | 0.000136 | 9.325017 | 0.000136 | 0.999864 | safety_canonical_v27 | 0 | true | 0.095238 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | UCMIRNVEIXFBKS-UHFFFAOYSA-N | KPSRODZRAIWAKH-UHFFFAOYSA-N | parent:UCMIRNVEIXFBKS-UHFFFAOYSA-N | c1ccc(C2CC2)cc1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "18.27",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 18.27,
"aggregate_max": 18.27,
"aggregate_q1": 18.27,... | {
"aggregation_method": "individual_record",
"display_measurement_text": "30.3",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 30.3,
"aggregate_max": 30.3,
"aggregate_q1": 30.3,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus), in vivo, bile-collection model; \u03b2-alanine-pretreated (taurine depletion) rats coinfused TCDC+UDC (group F); intact metabolic competence.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","conf... | {"assay_format":"in_vivo_animal","biological_system_context":"Male wild-type mice (Mus musculus); in vivo bile collection; metabolic competence: intact in vivo system; units per 100 g body weight","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"i... | L4 | gold_v1 | sr_c369c3f6667e4396b11581e21f34079e | sr_19655acb45a14205aca1078fbaec5115 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>NCCC(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus), in vivo, bile-collection model; β-alanine-pretreated (taurine depletion) ... | (B) | train | caca30f268e2e2d11046ae192e861638b44aef9100106d19694da269d6c6549f | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:32e00f1154dbb58ce37df0104fe3b80ee3378363957e182b93c27559330908f4 | dili:79711e38deb67325affb51896f2dc6386c59f0b9d653e2b0daa75e2c463fcbf4 | dili:32e00f1154dbb58ce37df0104fe3b80ee3378363957e182b93c27559330908f4 | dili:79711e38deb67325affb51896f2dc6386c59f0b9d653e2b0daa75e2c463fcbf4 | DKPMWHFRUGMUKF-CRKPLTDNSA-N | UCMIRNVEIXFBKS-UHFFFAOYSA-N | C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | NCCC(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo bile-collection study; Sprague-Dawley rats (n=3-4 experiments). Intact animal, intrinsically metabolically competent per protocol.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus), in vivo, bile-collection model; β-alanine-pretreated (taurine depletion) rats coinfused TCDC+UDC (group F); intact metabolic competence.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"en... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 13 | 18.27 | 5.27 | 9.325017 | {
"nontransfer": 0.8390888516375317,
"transfer": 0.16091114836246836
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 5.27 | 0.565146 | 0.160911 | 9.325017 | 0.160911 | 0.839089 | safety_canonical_v27 | 0 | true | 0.16 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | DKPMWHFRUGMUKF-CRKPLTDNSA-N | UCMIRNVEIXFBKS-UHFFFAOYSA-N | C1CCC2C(C1)CCC1C3CCCC3CCC21 | parent:UCMIRNVEIXFBKS-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "13",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 13,
"aggregate_max": 13,
"aggregate_q1": 13,
"aggregat... | {
"aggregation_method": "individual_record",
"display_measurement_text": "18.27",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 18.27,
"aggregate_max": 18.27,
"aggregate_q1": 18.27,... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo bile-collection study; Sprague-Dawley rats (n=3-4 experiments). Intact animal, intrinsically metabolically competent per protocol.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_directio... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus), in vivo, bile-collection model; \u03b2-alanine-pretreated (taurine depletion) rats coinfused TCDC+UDC (group F); intact metabolic competence.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","conf... | L4 | gold_v1 | sr_94f588ab3baa4327a97d1d188f52e534 | sr_c369c3f6667e4396b11581e21f34079e | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Male rats (Rattus norvegicus), in vivo, timed bil... | (B) | train | d2b4a26c52f4367e587e39b3b7de20a1537de54c22478c32d1ad41b8f592dd49 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:8130a61e464897b7b951670ffdf271fd0de7852501950e364cec1d6ba39c6910 | dili:32689c2b57e4228d1a9519ea72deb8452513798897810c8dd6f15cfefe32a277 | dili:8130a61e464897b7b951670ffdf271fd0de7852501950e364cec1d6ba39c6910 | dili:32689c2b57e4228d1a9519ea72deb8452513798897810c8dd6f15cfefe32a277 | KPSRODZRAIWAKH-UHFFFAOYSA-N | YPHMISFOHDHNIV-FSZOTQKASA-N | CC(C)(Oc1ccc(C2CC2(Cl)Cl)cc1)C(=O)O | C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Male wild-type mice (Mus musculus); in vivo bile collection; metabolic competence: intact in vivo system; units per 100 g body weight",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate... | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 30.3 | 4.06 | 26.24 | 9.325017 | {
"nontransfer": 0.9999999999671595,
"transfer": 3.284048490704248e-11
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 26.24 | 2.813936 | 0 | 9.325017 | 0 | 1 | safety_canonical_v27 | 0 | true | 0.114754 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | KPSRODZRAIWAKH-UHFFFAOYSA-N | YPHMISFOHDHNIV-FSZOTQKASA-N | c1ccc(C2CC2)cc1 | O=C1CC(CCC2CCCCC2=O)CC(=O)N1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "30.3",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 30.3,
"aggregate_max": 30.3,
"aggregate_q1": 30.3,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.06",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.06,
"aggregate_max": 4.06,
"aggregate_q1": 4.06,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Male wild-type mice (Mus musculus); in vivo bile collection; metabolic competence: intact in vivo system; units per 100 g body weight","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"i... | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase","endpoint_metric":"bile flow rate","endp... | L4 | gold_v1 | sr_19655acb45a14205aca1078fbaec5115 | sr_d2a6f3c9e2c444fd94496ea3fdd30f9e | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Male rats (Rattus norvegicus), in vivo, timed bil... | (B) | train | face478c2e4771c0dd6db873376905de88e3d962cf1a152fcbf0d87ce114e50f | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:cb323b9f1c7dd04805b87ba450736683b22e79809056020d5364181aa974bac0 | dili:8594b20023e2972b71590f545290aca80cb67a1a24387f80a4d98de5b6379f74 | dili:cb323b9f1c7dd04805b87ba450736683b22e79809056020d5364181aa974bac0 | dili:8594b20023e2972b71590f545290aca80cb67a1a24387f80a4d98de5b6379f74 | KPSRODZRAIWAKH-UHFFFAOYSA-N | YPHMISFOHDHNIV-FSZOTQKASA-N | CC(C)(Oc1ccc(C2CC2(Cl)Cl)cc1)C(=O)O | C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Wild-type and Pparα(-/-) SV129 mice, in vivo bile collection (n=7-10 per group); intrinsically metabolically competent in vivo system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rat... | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 30.3 | 6.8 | 23.5 | 9.325017 | {
"nontransfer": 0.9999999993798294,
"transfer": 6.201705451555093e-10
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 23.5 | 2.520103 | 0 | 9.325017 | 0 | 1 | safety_canonical_v27 | 0 | true | 0.114754 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | KPSRODZRAIWAKH-UHFFFAOYSA-N | YPHMISFOHDHNIV-FSZOTQKASA-N | c1ccc(C2CC2)cc1 | O=C1CC(CCC2CCCCC2=O)CC(=O)N1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "30.3",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 30.3,
"aggregate_max": 30.3,
"aggregate_q1": 30.3,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "6.8",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 6.8,
"aggregate_max": 6.8,
"aggregate_q1": 6.8,
"aggr... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Wild-type and Ppar\u03b1(-/-) SV129 mice, in vivo bile collection (n=7-10 per group); intrinsically metabolically competent in vivo system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_directi... | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase","endpoint_metric":"bile flow rate","endp... | L4 | gold_v1 | sr_38ddc4a129ed4f1d9623f10dbfa65e9f | sr_8671a76ad38344b594755b5d2d018137 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: In vivo male... | (B) | train | c82d4b2a3cffa22be061f9456986a9d435c85598b24c1ec75c60a2bfb9e46097 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:8594b20023e2972b71590f545290aca80cb67a1a24387f80a4d98de5b6379f74 | dili:585216628833c092b974ed7686b0d83aa37d683d966c2bc8891183857cdba3f3 | dili:8594b20023e2972b71590f545290aca80cb67a1a24387f80a4d98de5b6379f74 | dili:585216628833c092b974ed7686b0d83aa37d683d966c2bc8891183857cdba3f3 | YPHMISFOHDHNIV-FSZOTQKASA-N | DKPMWHFRUGMUKF-GDYCBZMLSA-N | C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1 | C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_me... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 6.8 | 18.76 | 11.96 | 9.325017 | {
"nontransfer": 0.999853115039638,
"transfer": 0.00014688496036194037
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 11.96 | 1.282571 | 0.000147 | 9.325017 | 0.000147 | 0.999853 | safety_canonical_v27 | 0 | true | 0.15942 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | YPHMISFOHDHNIV-FSZOTQKASA-N | DKPMWHFRUGMUKF-GDYCBZMLSA-N | O=C1CC(CCC2CCCCC2=O)CC(=O)N1 | C1CCC2C(C1)CCC1C3CCCC3CCC21 | {
"aggregation_method": "individual_record",
"display_measurement_text": "6.8",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 6.8,
"aggregate_max": 6.8,
"aggregate_q1": 6.8,
"aggr... | {
"aggregation_method": "individual_record",
"display_measurement_text": "18.76",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 18.76,
"aggregate_max": 18.76,
"aggregate_q1": 18.76,... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase","endpoint_metric":"bile flow rate","endp... | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"... | L4 | gold_v1 | sr_8671a76ad38344b594755b5d2d018137 | sr_2e7e6b62948e4bee8840080aec5c1f56 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CCSCC[C@H](N)C(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group
- C... | (A) | train | 9cd23c4be47b2547e342c474a134e5a1727c713286c158ba6e8fb4d04922322f | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:a1d3ebcf5f469c0a632cab858b2c72c97e6273d2e9f60c1096da3d9ff4984acb | dili:40647c681f6bc3cab99cb8a92b684c56c05243b67622d3ed853b6b394ef58693 | dili:a1d3ebcf5f469c0a632cab858b2c72c97e6273d2e9f60c1096da3d9ff4984acb | dili:40647c681f6bc3cab99cb8a92b684c56c05243b67622d3ed853b6b394ef58693 | AZKVWQKMDGGDSV-BCMRRPTOSA-N | GGLZPLKKBSSKCX-YFKPBYRVSA-N | COC(=O)C1=CO[C@@H](O)[C@@H]2C(CO)=CC[C@H]12 | CCSCC[C@H](N)C(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Sprague-Dawley rats, in vivo bile collection",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flow",
"exposure_conditions=genipin orall... | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 7.02 | 4.11 | 2.91 | 9.325017 | {
"nontransfer": 0.29330995634135326,
"transfer": 0.7066900436586467
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 2.91 | 0.312064 | 0.70669 | 9.325017 | 0.70669 | 0.29331 | safety_canonical_v27 | 1 | true | 0.089286 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | AZKVWQKMDGGDSV-BCMRRPTOSA-N | GGLZPLKKBSSKCX-YFKPBYRVSA-N | C1=CC2COC=CC2C1 | parent:GGLZPLKKBSSKCX-YFKPBYRVSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.02",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.02,
"aggregate_max": 7.02,
"aggregate_q1": 7.02,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.11",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.11,
"aggregate_max": 4.11,
"aggregate_q1": 4.11,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Sprague-Dawley rats, in vivo bile collection","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase","endpoint_metric":"bile flow rate","endpoint_name":"biliary_secretion_or_bile_fl... | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"increase","endpoint_metric":"bile flow rate","end... | L4 | gold_v1 | sr_0c9d68f22b534e68a2076c18bcb48111 | sr_3e35e9025cd54d798701ec3ad7e71a9a | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>COc1cc2c(c(OC)c1OC)-c1ccc(OC)c(=O)cc1[C@@H](NC(C)=O)CC2</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rattus norvegicus (rat), intact in vivo system (meta... | (B) | train | 3f4541e79249b87e4c6b5e7ee64d96ce5247decf3caccfd21a3ac501644bc7b7 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:9dee46f49be1a7877c963e10dba295f26374aca2325f2e47d0dd418452eb56b3 | dili:92e4e559cb6021ffa17757dbd3d0e5a6057fed83c2a26fdc5930ba6ef0a55876 | dili:9dee46f49be1a7877c963e10dba295f26374aca2325f2e47d0dd418452eb56b3 | dili:92e4e559cb6021ffa17757dbd3d0e5a6057fed83c2a26fdc5930ba6ef0a55876 | ITRJWOMZKQRYTA-RFZYENFJSA-N | IAKHMKGGTNLKSZ-INIZCTEOSA-N | CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3C(=O)C[C@@]21C | COc1cc2c(c(OC)c1OC)-c1ccc(OC)c(=O)cc1[C@@H](NC(C)=O)CC2 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile-acid-independent ... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rattus norvegicus (rat), intact in vivo system (metabolically competent), colchicine-treated for 8 hr; bile collected and measured.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 4.43 | 7.4 | 2.97 | 5.5845 | {
"nontransfer": 0.7888973468392615,
"transfer": 0.21110265316073848
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 2.97 | 0.531829 | 0.211103 | 5.5845 | 0.211103 | 0.788897 | safety_canonical_v27 | 0 | true | 0.159091 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ITRJWOMZKQRYTA-RFZYENFJSA-N | IAKHMKGGTNLKSZ-INIZCTEOSA-N | O=C1C=C2CCC3C4CCCC4CC(=O)C3C2CC1 | O=c1cccc2c(c1)CCCc1ccccc1-2 | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.43",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.43,
"aggregate_max": 4.43,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.4",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.4,
"aggregate_max": 7.4,
"aggregate_q1": ... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"no_change... | {"assay_format":"in_vivo_animal","biological_system_context":"Rattus norvegicus (rat), intact in vivo system (metabolically competent), colchicine-treated for 8 hr; bile collected and measured.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"dec... | L4 | gold_v1 | sr_52188b0589eb43ada64e7fab1b5bd593 | sr_91bbdf701b3d4cbfa8023dcfc56fb2e7 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CCSCC[C@H](N)C(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group
- C... | (B) | train | d61174655da52f79e1f8668160d9ec22a8463047a46f84eab54e992fe0a1d8cf | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:585216628833c092b974ed7686b0d83aa37d683d966c2bc8891183857cdba3f3 | dili:40647c681f6bc3cab99cb8a92b684c56c05243b67622d3ed853b6b394ef58693 | dili:585216628833c092b974ed7686b0d83aa37d683d966c2bc8891183857cdba3f3 | dili:40647c681f6bc3cab99cb8a92b684c56c05243b67622d3ed853b6b394ef58693 | DKPMWHFRUGMUKF-GDYCBZMLSA-N | GGLZPLKKBSSKCX-YFKPBYRVSA-N | C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | CCSCC[C@H](N)C(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_me... | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 18.76 | 4.11 | 14.65 | 9.325017 | {
"nontransfer": 0.9999917922803844,
"transfer": 0.000008207719615573345
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 14.65 | 1.571043 | 0.000008 | 9.325017 | 0.000008 | 0.999992 | safety_canonical_v27 | 0 | true | 0.133333 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | DKPMWHFRUGMUKF-GDYCBZMLSA-N | GGLZPLKKBSSKCX-YFKPBYRVSA-N | C1CCC2C(C1)CCC1C3CCCC3CCC21 | parent:GGLZPLKKBSSKCX-YFKPBYRVSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "18.76",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 18.76,
"aggregate_max": 18.76,
"aggregate_q1": 18.76,... | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.11",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.11,
"aggregate_max": 4.11,
"aggregate_q1": 4.11,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"... | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"increase","endpoint_metric":"bile flow rate","end... | L4 | gold_v1 | sr_2e7e6b62948e4bee8840080aec5c1f56 | sr_3e35e9025cd54d798701ec3ad7e71a9a | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CCSCC[C@H](N)C(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group
- C... | (A) | train | 052704505c1a72e7abf462367db0730170af4a2d45896c12f0e75ce5dbe1d8d5 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:530894f53b6346e450e3f5214ee1f0722c91914516a7f04b74de05630d295473 | dili:40647c681f6bc3cab99cb8a92b684c56c05243b67622d3ed853b6b394ef58693 | dili:530894f53b6346e450e3f5214ee1f0722c91914516a7f04b74de05630d295473 | dili:40647c681f6bc3cab99cb8a92b684c56c05243b67622d3ed853b6b394ef58693 | WEXRUCMBJFQVBZ-UHFFFAOYSA-N | GGLZPLKKBSSKCX-YFKPBYRVSA-N | CCCC(C)C1(CC)C(=O)NC(=O)NC1=O | CCSCC[C@H](N)C(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo rats (Rattus norvegicus) with eight days biliary drainage (BD group); metabolically competent intact in vivo system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile acid-independent f... | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 2.38 | 4.11 | 1.73 | 9.325017 | {
"nontransfer": 0.1048204441646895,
"transfer": 0.8951795558353105
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 1.73 | 0.185522 | 0.89518 | 9.325017 | 0.89518 | 0.10482 | safety_canonical_v27 | 1 | true | 0.142857 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | WEXRUCMBJFQVBZ-UHFFFAOYSA-N | GGLZPLKKBSSKCX-YFKPBYRVSA-N | O=C1CC(=O)NC(=O)N1 | parent:GGLZPLKKBSSKCX-YFKPBYRVSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "2.38",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2.38,
"aggregate_max": 2.38,
"aggregate_q1": 2.38,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.11",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.11,
"aggregate_max": 4.11,
"aggregate_q1": 4.11,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo rats (Rattus norvegicus) with eight days biliary drainage (BD group); metabolically competent intact in vivo system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.8,"effect_direction":"increase",... | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"increase","endpoint_metric":"bile flow rate","end... | L4 | gold_v1 | sr_fe6b04f2fd644b86b6c89167ebb035a1 | sr_3e35e9025cd54d798701ec3ad7e71a9a | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: In vivo male... | (B) | train | cc3bcfeb3900e4c54c9064e40b17e4c3a836e6a041cf7a60745cf6baf96d1575 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:21c4e80fadd27673efd0e708e1809b2464e24a8e6dafceba42d0fd9f9e9e9717 | dili:585216628833c092b974ed7686b0d83aa37d683d966c2bc8891183857cdba3f3 | dili:21c4e80fadd27673efd0e708e1809b2464e24a8e6dafceba42d0fd9f9e9e9717 | dili:585216628833c092b974ed7686b0d83aa37d683d966c2bc8891183857cdba3f3 | YPHMISFOHDHNIV-FSZOTQKASA-N | DKPMWHFRUGMUKF-GDYCBZMLSA-N | C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1 | C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat in vivo; bile collection with maximal bile-acid stimulation, 16 h after cycloheximide",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=maximal bile flow",
"endpoint_name=biliary_secretion_or_... | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_me... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 10.6 | 18.76 | 8.16 | 9.325017 | {
"nontransfer": 0.991428077277803,
"transfer": 0.008571922722196968
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 8.16 | 0.875065 | 0.008572 | 9.325017 | 0.008572 | 0.991428 | safety_canonical_v27 | 0 | true | 0.15942 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | YPHMISFOHDHNIV-FSZOTQKASA-N | DKPMWHFRUGMUKF-GDYCBZMLSA-N | O=C1CC(CCC2CCCCC2=O)CC(=O)N1 | C1CCC2C(C1)CCC1C3CCCC3CCC21 | {
"aggregation_method": "individual_record",
"display_measurement_text": "10.6",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 10.6,
"aggregate_max": 10.6,
"aggregate_q1": 10.6,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "18.76",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 18.76,
"aggregate_max": 18.76,
"aggregate_q1": 18.76,... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat in vivo; bile collection with maximal bile-acid stimulation, 16 h after cycloheximide","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"decrease","endpoint_metric":"maximal bile fl... | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"... | L4 | gold_v1 | sr_87527682a95540b7ab2d5d24cc3ade6e | sr_2e7e6b62948e4bee8840080aec5c1f56 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus) in viv... | (B) | train | 110215dda8f04eb8685491d8cabfba190e18f8312478ade3ccd2700326a500b1 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:92e4e559cb6021ffa17757dbd3d0e5a6057fed83c2a26fdc5930ba6ef0a55876 | dili:182e1713eb9965d45677af92b3e9f1e05f2bd9cce55eea95950a5c4623b57081 | dili:92e4e559cb6021ffa17757dbd3d0e5a6057fed83c2a26fdc5930ba6ef0a55876 | dili:182e1713eb9965d45677af92b3e9f1e05f2bd9cce55eea95950a5c4623b57081 | IAKHMKGGTNLKSZ-INIZCTEOSA-N | MECYMOKOKLARJV-PCNQZJBLSA-N | COc1cc2c(c(OC)c1OC)-c1ccc(OC)c(=O)cc1[C@@H](NC(C)=O)CC2 | C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rattus norvegicus (rat), intact in vivo system (metabolically competent), colchicine-treated for 8 hr; bile collected and measured.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 7.4 | 0.27 | 7.13 | 5.5845 | {
"nontransfer": 0.9998443089691029,
"transfer": 0.00015569103089712528
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 7.13 | 1.276748 | 0.000156 | 5.5845 | 0.000156 | 0.999844 | safety_canonical_v27 | 0 | true | 0.1 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | IAKHMKGGTNLKSZ-INIZCTEOSA-N | MECYMOKOKLARJV-PCNQZJBLSA-N | O=c1cccc2c(c1)CCCc1ccccc1-2 | C1=C2CCCCC2C2CCC3CCCC3C2C1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.4",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.4,
"aggregate_max": 7.4,
"aggregate_q1": ... | {
"aggregation_method": "individual_record",
"display_measurement_text": "0.27",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 0.27,
"aggregate_max": 0.27,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rattus norvegicus (rat), intact in vivo system (metabolically competent), colchicine-treated for 8 hr; bile collected and measured.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"dec... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"decrea... | L4 | gold_v1 | sr_91bbdf701b3d4cbfa8023dcfc56fb2e7 | sr_5916d18874cd46a487a6aef7541223af | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>COC(=O)C1=CO[C@@H](O)[C@@H]2C(CO)=CC[C@H]12</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Sprague-Dawley rats, in vivo bile collection
- Canonical assay c... | (B) | train | c746d28de7ce0803a848cc0f49dd794f3d859e322a6b3c67965b81f59ae243b3 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:e95335d99af822c5d343f9a88c23c529c7627dca123ac0d13f0da13743177049 | dili:a1d3ebcf5f469c0a632cab858b2c72c97e6273d2e9f60c1096da3d9ff4984acb | dili:e95335d99af822c5d343f9a88c23c529c7627dca123ac0d13f0da13743177049 | dili:a1d3ebcf5f469c0a632cab858b2c72c97e6273d2e9f60c1096da3d9ff4984acb | VFNGKCDDZUSWLR-UHFFFAOYSA-N | AZKVWQKMDGGDSV-BCMRRPTOSA-N | O=S(=O)(O)OS(=O)(=O)O | COC(=O)C1=CO[C@@H](O)[C@@H]2C(CO)=CC[C@H]12 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo bile-collection study; Sprague-Dawley rats (n=3-4 experiments). Intact animal, intrinsically metabolically competent per protocol.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow... | [
"assay_format=in_vivo_animal",
"biological_system_context=Sprague-Dawley rats, in vivo bile collection",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flow",
"exposure_conditions=genipin orall... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 14.9 | 7.02 | 7.88 | 9.325017 | {
"nontransfer": 0.9884606601769477,
"transfer": 0.011539339823052283
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 7.88 | 0.845039 | 0.011539 | 9.325017 | 0.011539 | 0.988461 | safety_canonical_v27 | 0 | true | 0.066667 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | VFNGKCDDZUSWLR-UHFFFAOYSA-N | AZKVWQKMDGGDSV-BCMRRPTOSA-N | parent:VFNGKCDDZUSWLR-UHFFFAOYSA-N | C1=CC2COC=CC2C1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "14.9",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 14.9,
"aggregate_max": 14.9,
"aggregate_q1": 14.9,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.02",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.02,
"aggregate_max": 7.02,
"aggregate_q1": 7.02,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo bile-collection study; Sprague-Dawley rats (n=3-4 experiments). Intact animal, intrinsically metabolically competent per protocol.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_directio... | {"assay_format":"in_vivo_animal","biological_system_context":"Sprague-Dawley rats, in vivo bile collection","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase","endpoint_metric":"bile flow rate","endpoint_name":"biliary_secretion_or_bile_fl... | L4 | gold_v1 | sr_654bdd09cb604a5fb88584a399179675 | sr_0c9d68f22b534e68a2076c18bcb48111 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>COC(=O)C1=CO[C@@H](O)[C@@H]2C(CO)=CC[C@H]12</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Sprague-Dawley rats, in vivo bile collection
- Canonical assay c... | (A) | train | e1cf413e0a0125021b28dcbe4d84be214bb267bc165551f0737c3cc5db9b091f | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:28e81598a8658dbfe44abd0947b0be027f1e3ca32001c70ed954b8522ee722ea | dili:a1d3ebcf5f469c0a632cab858b2c72c97e6273d2e9f60c1096da3d9ff4984acb | dili:28e81598a8658dbfe44abd0947b0be027f1e3ca32001c70ed954b8522ee722ea | dili:a1d3ebcf5f469c0a632cab858b2c72c97e6273d2e9f60c1096da3d9ff4984acb | YPHMISFOHDHNIV-FSZOTQKASA-N | AZKVWQKMDGGDSV-BCMRRPTOSA-N | C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1 | COC(=O)C1=CO[C@@H](O)[C@@H]2C(CO)=CC[C@H]12 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | [
"assay_format=in_vivo_animal",
"biological_system_context=Sprague-Dawley rats, in vivo bile collection",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flow",
"exposure_conditions=genipin orall... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 5.38 | 7.02 | 1.64 | 9.325017 | {
"nontransfer": 0.09610341909009168,
"transfer": 0.9038965809099083
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 1.64 | 0.175871 | 0.903897 | 9.325017 | 0.903897 | 0.096103 | safety_canonical_v27 | 1 | true | 0.106061 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | YPHMISFOHDHNIV-FSZOTQKASA-N | AZKVWQKMDGGDSV-BCMRRPTOSA-N | O=C1CC(CCC2CCCCC2=O)CC(=O)N1 | C1=CC2COC=CC2C1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "5.38",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 5.38,
"aggregate_max": 5.38,
"aggregate_q1": 5.38,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.02",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.02,
"aggregate_max": 7.02,
"aggregate_q1": 7.02,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"increase","endpoint_metric":"bile flow rate","end... | {"assay_format":"in_vivo_animal","biological_system_context":"Sprague-Dawley rats, in vivo bile collection","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase","endpoint_metric":"bile flow rate","endpoint_name":"biliary_secretion_or_bile_fl... | L4 | gold_v1 | sr_8a4af9c65db445db8f03d24a765dbc72 | sr_0c9d68f22b534e68a2076c18bcb48111 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3C(=O)C[C@@]21C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus) in vi... | (B) | train | a99a413e7e8fbecad4f1c8a5e53b3484744b2336db9d1a3cd30e503284110188 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:23fce8cdc1a3034e8a61beb7be05f27ce53664c8a613c384a1f4826b287a3b1e | dili:9dee46f49be1a7877c963e10dba295f26374aca2325f2e47d0dd418452eb56b3 | dili:23fce8cdc1a3034e8a61beb7be05f27ce53664c8a613c384a1f4826b287a3b1e | dili:9dee46f49be1a7877c963e10dba295f26374aca2325f2e47d0dd418452eb56b3 | GHCZAUBVMUEKKP-XROMFQGDSA-N | ITRJWOMZKQRYTA-RFZYENFJSA-N | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3C(=O)C[C@@]21C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rats, in vivo bile-collection experiment",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate at Tm",
"endpoint_name=biliary_secretion_or_bile_flow",
"exposure_conditions=Glycoursode... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile-acid-independent ... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 15.45 | 4.43 | 11.02 | 5.5845 | {
"nontransfer": 0.9999998530524573,
"transfer": 1.4694754271266235e-7
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 11.02 | 1.973319 | 0 | 5.5845 | 0 | 1 | safety_canonical_v27 | 0 | true | 0.150538 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | GHCZAUBVMUEKKP-XROMFQGDSA-N | ITRJWOMZKQRYTA-RFZYENFJSA-N | C1CCC2C(C1)CCC1C3CCCC3CCC21 | O=C1C=C2CCC3C4CCCC4CC(=O)C3C2CC1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "15.45",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 15.45,
"aggregate_max": 15.45,
"aggregate... | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.43",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.43,
"aggregate_max": 4.43,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rats, in vivo bile-collection experiment","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"present","endpoint_metric":"bile flow rate at Tm","endpoint_name":"biliary_secretion_or_bile_... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"no_change... | L4 | gold_v1 | sr_e6b4d77b904f460995dbf02ba8653c2b | sr_52188b0589eb43ada64e7fab1b5bd593 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>NCCS(=O)(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: APAP-treated hamsters (Mesocricetus auratus), in vivo, three to six animals per group; intact ... | (B) | train | 9e50743ce1730e52f26babdac2fbf3952313d0d88818c4e14ab7c2a4a16d3015 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:6323cf83ec5257a8d7a665b401a4d2b0196c3c6a4cd48ff522e6c5d597c4a644 | dili:e95b60eec6736d3b87d0d1a110d065283935c315862ab97eab1215d5ccceb86f | dili:6323cf83ec5257a8d7a665b401a4d2b0196c3c6a4cd48ff522e6c5d597c4a644 | dili:e95b60eec6736d3b87d0d1a110d065283935c315862ab97eab1215d5ccceb86f | MUBZPKHOEPUJKR-UHFFFAOYSA-N | XOAAWQZATWQOTB-UHFFFAOYSA-N | O=C(O)C(=O)O | NCCS(=O)(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
... | [
"assay_format=in_vivo_animal",
"biological_system_context=APAP-treated hamsters (Mesocricetus auratus), in vivo, three to six animals per group; intact in vivo system, intrinsically metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 1.87 | 7.72 | 5.85 | 5.5845 | {
"nontransfer": 0.9984615235569226,
"transfer": 0.0015384764430773918
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 5.85 | 1.047542 | 0.001538 | 5.5845 | 0.001538 | 0.998462 | safety_canonical_v27 | 0 | true | 0.111111 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | MUBZPKHOEPUJKR-UHFFFAOYSA-N | XOAAWQZATWQOTB-UHFFFAOYSA-N | parent:MUBZPKHOEPUJKR-UHFFFAOYSA-N | parent:XOAAWQZATWQOTB-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "1.87",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 1.87,
"aggregate_max": 1.87,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.72",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.72,
"aggregate_max": 7.72,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"decrea... | {"assay_format":"in_vivo_animal","biological_system_context":"APAP-treated hamsters (Mesocricetus auratus), in vivo, three to six animals per group; intact in vivo system, intrinsically metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.75,"effe... | L4 | gold_v1 | sr_d600728bdfb849beb6d6bda1d35afcf8 | sr_dd3de8c090584b9d9289080b8289b1a5 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>NCCC(=O)O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus), in vivo, bile-collection model; β-alanine-pretreated (taurine depletion) ... | (A) | train | 29e300c4b1ac9b0a3f3beb3f6c091d67f41ec8219a969d00c3db26d49d4b7860 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:ae3f62ea784940a5875c7864839486fee1f002880101a68f8ab7cefa8e9e86a6 | dili:79711e38deb67325affb51896f2dc6386c59f0b9d653e2b0daa75e2c463fcbf4 | dili:ae3f62ea784940a5875c7864839486fee1f002880101a68f8ab7cefa8e9e86a6 | dili:79711e38deb67325affb51896f2dc6386c59f0b9d653e2b0daa75e2c463fcbf4 | DKPMWHFRUGMUKF-CRKPLTDNSA-N | UCMIRNVEIXFBKS-UHFFFAOYSA-N | C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | NCCC(=O)O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_me... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus), in vivo, bile-collection model; β-alanine-pretreated (taurine depletion) rats coinfused TCDC+UDC (group F); intact metabolic competence.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"en... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 18.85 | 18.27 | 0.58 | 9.325017 | {
"nontransfer": 0.0329895896082526,
"transfer": 0.9670104103917474
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 0.58 | 0.062198 | 0.96701 | 9.325017 | 0.96701 | 0.03299 | safety_canonical_v27 | 1 | true | 0.16 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | DKPMWHFRUGMUKF-CRKPLTDNSA-N | UCMIRNVEIXFBKS-UHFFFAOYSA-N | C1CCC2C(C1)CCC1C3CCCC3CCC21 | parent:UCMIRNVEIXFBKS-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "18.85",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 18.85,
"aggregate_max": 18.85,
"aggregate_q1": 18.85,... | {
"aggregation_method": "individual_record",
"display_measurement_text": "18.27",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 18.27,
"aggregate_max": 18.27,
"aggregate_q1": 18.27,... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo male Wistar rats (each n=3), metabolically competent, infusion study measuring bile flow, bile salt excretion rate and bicarbonate concentration","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus), in vivo, bile-collection model; \u03b2-alanine-pretreated (taurine depletion) rats coinfused TCDC+UDC (group F); intact metabolic competence.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","conf... | L4 | gold_v1 | sr_e0dd87d38fae4210ae54dbe4c0107f6b | sr_c369c3f6667e4396b11581e21f34079e | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus) in viv... | (B) | train | 50027288c917b8f40928dc0133488f697de42505d921a59769362c19993f1330 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:51532c46b483b0f9a8d73b49375551eea075129f5de34ea06c719c95ac522f90 | dili:182e1713eb9965d45677af92b3e9f1e05f2bd9cce55eea95950a5c4623b57081 | dili:51532c46b483b0f9a8d73b49375551eea075129f5de34ea06c719c95ac522f90 | dili:182e1713eb9965d45677af92b3e9f1e05f2bd9cce55eea95950a5c4623b57081 | SGIWFELWJPNFDH-UHFFFAOYSA-N | MECYMOKOKLARJV-PCNQZJBLSA-N | O=S(=O)(c1ccccc1)N(CC(F)(F)F)c1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1 | C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Male C57BL/6J mice, 2-3 months old, in vivo; metabolic competence: intact in vivo (intrinsically competent)",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliar... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 7.8 | 0.27 | 7.53 | 5.5845 | {
"nontransfer": 0.9999239276501013,
"transfer": 0.00007607234989872531
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 7.53 | 1.348375 | 0.000076 | 5.5845 | 0.000076 | 0.999924 | safety_canonical_v27 | 0 | true | 0.087912 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | SGIWFELWJPNFDH-UHFFFAOYSA-N | MECYMOKOKLARJV-PCNQZJBLSA-N | O=S(=O)(Nc1ccccc1)c1ccccc1 | C1=C2CCCCC2C2CCC3CCCC3C2C1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.8",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.8,
"aggregate_max": 7.8,
"aggregate_q1": ... | {
"aggregation_method": "individual_record",
"display_measurement_text": "0.27",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 0.27,
"aggregate_max": 0.27,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Male C57BL/6J mice, 2-3 months old, in vivo; metabolic competence: intact in vivo (intrinsically competent)","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"no_change","endpoint_metric... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"decrea... | L4 | gold_v1 | sr_6140b053a4284068ba3638c97504989b | sr_5916d18874cd46a487a6aef7541223af | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CN(C)CCO</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Adult male Wistar rats with an external bile fistula and jugular catheter, in vivo; baseline saline... | (A) | train | 2c7b163bbe32c7ba9e935fe2d506c6487b33625a462b76feade482884807d99a | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:40647c681f6bc3cab99cb8a92b684c56c05243b67622d3ed853b6b394ef58693 | dili:bbe7c9cb57f743e44885a7c45a1fff29fdd54a0470486dac89653fb7d6254e84 | dili:40647c681f6bc3cab99cb8a92b684c56c05243b67622d3ed853b6b394ef58693 | dili:bbe7c9cb57f743e44885a7c45a1fff29fdd54a0470486dac89653fb7d6254e84 | GGLZPLKKBSSKCX-YFKPBYRVSA-N | UEEJHVSXFDXPFK-UHFFFAOYSA-N | CCSCC[C@H](N)C(=O)O | CN(C)CCO | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | [
"assay_format=in_vivo_animal",
"biological_system_context=Adult male Wistar rats with an external bile fistula and jugular catheter, in vivo; baseline saline infusion to wash out endogenous bile salt pool.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 4.11 | 2.3 | 1.81 | 9.325017 | {
"nontransfer": 0.11314766464366122,
"transfer": 0.8868523353563388
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 1.81 | 0.194102 | 0.886852 | 9.325017 | 0.886852 | 0.113148 | safety_canonical_v27 | 1 | true | 0.09375 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | GGLZPLKKBSSKCX-YFKPBYRVSA-N | UEEJHVSXFDXPFK-UHFFFAOYSA-N | parent:GGLZPLKKBSSKCX-YFKPBYRVSA-N | parent:UEEJHVSXFDXPFK-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.11",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.11,
"aggregate_max": 4.11,
"aggregate_q1": 4.11,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "2.3",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2.3,
"aggregate_max": 2.3,
"aggregate_q1": 2.3,
"aggr... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_direction":"increase","endpoint_metric":"bile flow rate","end... | {"assay_format":"in_vivo_animal","biological_system_context":"Adult male Wistar rats with an external bile fistula and jugular catheter, in vivo; baseline saline infusion to wash out endogenous bile salt pool.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect... | L4 | gold_v1 | sr_3e35e9025cd54d798701ec3ad7e71a9a | sr_e23e2eaa4b19487281e3ca47eec1d24c | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3C(=O)C[C@@]21C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus) in vi... | (B) | train | 0a08ea30315d8c766142405e1a992190a07ec2d934c15c5a64edd69419bf6485 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:182e1713eb9965d45677af92b3e9f1e05f2bd9cce55eea95950a5c4623b57081 | dili:9dee46f49be1a7877c963e10dba295f26374aca2325f2e47d0dd418452eb56b3 | dili:182e1713eb9965d45677af92b3e9f1e05f2bd9cce55eea95950a5c4623b57081 | dili:9dee46f49be1a7877c963e10dba295f26374aca2325f2e47d0dd418452eb56b3 | MECYMOKOKLARJV-PCNQZJBLSA-N | ITRJWOMZKQRYTA-RFZYENFJSA-N | C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C | CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3C(=O)C[C@@]21C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile-acid-independent ... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 0.27 | 4.43 | 4.16 | 5.5845 | {
"nontransfer": 0.96920696653719,
"transfer": 0.03079303346281004
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 4.16 | 0.744919 | 0.030793 | 5.5845 | 0.030793 | 0.969207 | safety_canonical_v27 | 0 | true | 0.195876 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | MECYMOKOKLARJV-PCNQZJBLSA-N | ITRJWOMZKQRYTA-RFZYENFJSA-N | C1=C2CCCCC2C2CCC3CCCC3C2C1 | O=C1C=C2CCC3C4CCCC4CC(=O)C3C2CC1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "0.27",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 0.27,
"aggregate_max": 0.27,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.43",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.43,
"aggregate_max": 4.43,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo with biliary collection; bile salt infused intravenously; metabolically competent intact system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"decrea... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"no_change... | L4 | gold_v1 | sr_5916d18874cd46a487a6aef7541223af | sr_52188b0589eb43ada64e7fab1b5bd593 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: In vivo... | (A) | train | c4c91f5d20355c9c72f890d18b24c12dbb803ab3ef19d40c25a594c4e68ac905 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:195ed61e8d1b0d5d2fb70b4161c368883e749a947146c6b81a4a5bc207d81eb0 | dili:cdc7b538cd367a59ebd7842a083e6e368139d1174b1556a671e84f3136199f86 | dili:195ed61e8d1b0d5d2fb70b4161c368883e749a947146c6b81a4a5bc207d81eb0 | dili:cdc7b538cd367a59ebd7842a083e6e368139d1174b1556a671e84f3136199f86 | DDBREPKUVSBGFI-UHFFFAOYSA-N | BHTRKEVKTKCXOH-LBSADWJPSA-N | CCC1(c2ccccc2)C(=O)NC(=O)NC1=O | C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo; individual animals (n up to 10) with bile collected after phenobarbital treatment; values are mean ± SEM.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow... | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo rat biliary excretion study; species Rattus norvegicus; intact metabolic competence",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate during Tm period",
"endpoint_name=bilia... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 13.8 | 15.9 | 2.1 | 5.5845 | {
"nontransfer": 0.44038696278160605,
"transfer": 0.559613037218394
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 2.1 | 0.376041 | 0.559613 | 5.5845 | 0.559613 | 0.440387 | safety_canonical_v27 | 1 | false | 0.051282 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | DDBREPKUVSBGFI-UHFFFAOYSA-N | BHTRKEVKTKCXOH-LBSADWJPSA-N | O=C1NC(=O)C(c2ccccc2)C(=O)N1 | C1CCC2C(C1)CCC1C3CCCC3CCC21 | {
"aggregation_method": "individual_record",
"display_measurement_text": "13.8",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 13.8,
"aggregate_max": 13.8,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "15.9",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 15.9,
"aggregate_max": 15.9,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo; individual animals (n up to 10) with bile collected after phenobarbital treatment; values are mean \u00b1 SEM.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_dir... | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo rat biliary excretion study; species Rattus norvegicus; intact metabolic competence","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"present","endpoint_metric":"bile flow rate ... | L4 | gold_v1 | sr_3c302991f01a4f06aa29a4a28d2a5407 | sr_9a6596cb8a914ad4871d994a3d52c1f9 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C</SMILES>
- Assay format: in_vivo_animal
- Biological system context: In vivo... | (B) | train | e89da8c6c2d6ddab36b452acb6d134f98c6657a72cd2afea7fc35a05cfde3194 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:e95b60eec6736d3b87d0d1a110d065283935c315862ab97eab1215d5ccceb86f | dili:cdc7b538cd367a59ebd7842a083e6e368139d1174b1556a671e84f3136199f86 | dili:e95b60eec6736d3b87d0d1a110d065283935c315862ab97eab1215d5ccceb86f | dili:cdc7b538cd367a59ebd7842a083e6e368139d1174b1556a671e84f3136199f86 | XOAAWQZATWQOTB-UHFFFAOYSA-N | BHTRKEVKTKCXOH-LBSADWJPSA-N | NCCS(=O)(=O)O | C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=APAP-treated hamsters (Mesocricetus auratus), in vivo, three to six animals per group; intact in vivo system, intrinsically metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric... | [
"assay_format=in_vivo_animal",
"biological_system_context=In vivo rat biliary excretion study; species Rattus norvegicus; intact metabolic competence",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate during Tm period",
"endpoint_name=bilia... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 7.72 | 15.9 | 8.18 | 5.5845 | {
"nontransfer": 0.9999762448039136,
"transfer": 0.000023755196086487524
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 8.18 | 1.464769 | 0.000024 | 5.5845 | 0.000024 | 0.999976 | safety_canonical_v27 | 0 | true | 0.145161 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | XOAAWQZATWQOTB-UHFFFAOYSA-N | BHTRKEVKTKCXOH-LBSADWJPSA-N | parent:XOAAWQZATWQOTB-UHFFFAOYSA-N | C1CCC2C(C1)CCC1C3CCCC3CCC21 | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.72",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.72,
"aggregate_max": 7.72,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "15.9",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 15.9,
"aggregate_max": 15.9,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"APAP-treated hamsters (Mesocricetus auratus), in vivo, three to six animals per group; intact in vivo system, intrinsically metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.75,"effe... | {"assay_format":"in_vivo_animal","biological_system_context":"In vivo rat biliary excretion study; species Rattus norvegicus; intact metabolic competence","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"present","endpoint_metric":"bile flow rate ... | L4 | gold_v1 | sr_dd3de8c090584b9d9289080b8289b1a5 | sr_9a6596cb8a914ad4871d994a3d52c1f9 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CCC1(c2ccccc2)C(=O)NC(=O)NC1=O</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in... | (A) | train | 2f25641e5f30b7aea41a0b474d1bb031978dcfb6622b2208d8f2fac34ca2b1d2 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:642f46db98fcfefd64b860bfa2d29ab4e81b49349142e96c276dc0184d6017ef | dili:12ac9f43e5181b1a9d82fe21da0fb6145b6d579a65d1f315991994d183a60977 | dili:642f46db98fcfefd64b860bfa2d29ab4e81b49349142e96c276dc0184d6017ef | dili:12ac9f43e5181b1a9d82fe21da0fb6145b6d579a65d1f315991994d183a60977 | DNIAPMSPPWPWGF-UHFFFAOYSA-N | DDBREPKUVSBGFI-UHFFFAOYSA-N | CC(O)CO | CCC1(c2ccccc2)C(=O)NC(=O)NC1=O | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile-acid-independent ... | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile-acid-independent ... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 4.79 | 6.61 | 1.82 | 5.5845 | {
"nontransfer": 0.3227899897356028,
"transfer": 0.6772100102643972
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 1.82 | 0.325902 | 0.67721 | 5.5845 | 0.67721 | 0.32279 | safety_canonical_v27 | 1 | true | 0.060606 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | DNIAPMSPPWPWGF-UHFFFAOYSA-N | DDBREPKUVSBGFI-UHFFFAOYSA-N | parent:DNIAPMSPPWPWGF-UHFFFAOYSA-N | O=C1NC(=O)C(c2ccccc2)C(=O)N1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.79",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.79,
"aggregate_max": 4.79,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "6.61",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 6.61,
"aggregate_max": 6.61,
"aggregate_q1... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"no_change... | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo, treatment given over several days; intact in vivo system treated as metabolically competent.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase"... | L4 | gold_v1 | sr_b051effdb7c548f7ac1a6aa1a01994a4 | sr_5f1a4bc38132448192f150870527230c | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>COC(=O)C1=CO[C@@H](O)[C@@H]2C(CO)=CC[C@H]12</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Sprague-Dawley rats, in vivo bile collection
- Canonical assay c... | (A) | train | 0417546dc4e8c070dcc29fe81bfc71607ded61479931309475e111b51a8166f3 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:32689c2b57e4228d1a9519ea72deb8452513798897810c8dd6f15cfefe32a277 | dili:a1d3ebcf5f469c0a632cab858b2c72c97e6273d2e9f60c1096da3d9ff4984acb | dili:32689c2b57e4228d1a9519ea72deb8452513798897810c8dd6f15cfefe32a277 | dili:a1d3ebcf5f469c0a632cab858b2c72c97e6273d2e9f60c1096da3d9ff4984acb | YPHMISFOHDHNIV-FSZOTQKASA-N | AZKVWQKMDGGDSV-BCMRRPTOSA-N | C[C@@H]1C[C@@H]([C@H](O)CC2CC(=O)NC(=O)C2)C(=O)[C@@H](C)C1 | COC(=O)C1=CO[C@@H](O)[C@@H]2C(CO)=CC[C@H]12 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flo... | [
"assay_format=in_vivo_animal",
"biological_system_context=Sprague-Dawley rats, in vivo bile collection",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliary_secretion_or_bile_flow",
"exposure_conditions=genipin orall... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 4.06 | 7.02 | 2.96 | 9.325017 | {
"nontransfer": 0.30454593527857987,
"transfer": 0.6954540647214201
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g\",\"__unknown__\",\"bile flow\",\"L4\"]",
"q... | 2.96 | 0.317426 | 0.695454 | 9.325017 | 0.695454 | 0.304546 | safety_canonical_v27 | 1 | true | 0.106061 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g","__unknown__","bile flow","L4"] | YPHMISFOHDHNIV-FSZOTQKASA-N | AZKVWQKMDGGDSV-BCMRRPTOSA-N | O=C1CC(CCC2CCCCC2=O)CC(=O)N1 | C1=CC2COC=CC2C1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "4.06",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 4.06,
"aggregate_max": 4.06,
"aggregate_q1": 4.06,
"... | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.02",
"display_unit_text": "µL/min/100 g",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.02,
"aggregate_max": 7.02,
"aggregate_q1": 7.02,
"... | 21 | 15 | 10 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Male rats (Rattus norvegicus), in vivo, timed bile collection; six animals per group","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase","endpoint_metric":"bile flow rate","endp... | {"assay_format":"in_vivo_animal","biological_system_context":"Sprague-Dawley rats, in vivo bile collection","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"increase","endpoint_metric":"bile flow rate","endpoint_name":"biliary_secretion_or_bile_fl... | L4 | gold_v1 | sr_d2a6f3c9e2c444fd94496ea3fdd30f9e | sr_0c9d68f22b534e68a2076c18bcb48111 | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g","__unknown__","bile flow"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>O=S(=O)(c1ccccc1)N(CC(F)(F)F)c1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1</SMILES>
- Assay format: in_vivo_animal
- Biological system context: Male C57BL/6J mice, 2-3 months old, in vivo; m... | (A) | train | 12b5df684e0c064b436e339a87c19debcec86eda78b3ff5ee140cfe27a954f54 | -1 | null | -1 | null | null | null | dili | dili_v3 | limited_balanced_parent_morgan_first.v28_safety | dili:3b7fbe8e584b862aef792235b051e8922b1d110d451c2852bf679ea6aeb04779 | dili:51532c46b483b0f9a8d73b49375551eea075129f5de34ea06c719c95ac522f90 | dili:3b7fbe8e584b862aef792235b051e8922b1d110d451c2852bf679ea6aeb04779 | dili:51532c46b483b0f9a8d73b49375551eea075129f5de34ea06c719c95ac522f90 | MUBZPKHOEPUJKR-UHFFFAOYSA-N | SGIWFELWJPNFDH-UHFFFAOYSA-N | O=C(O)C(=O)O | O=S(=O)(c1ccccc1)N(CC(F)(F)F)c1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1 | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"assay_format=in_vivo_animal",
"biological_system_context=Rat (Rattus norvegicus) in vivo with biliary collection; co-infused bile salts given intravenously; metabolically competent intact system.",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow... | [
"assay_format=in_vivo_animal",
"biological_system_context=Male C57BL/6J mice, 2-3 months old, in vivo; metabolic competence: intact in vivo (intrinsically competent)",
"canonical_assay_context=bile flow",
"canonical_measurement_scale_id=__unknown__",
"endpoint_metric=bile flow rate",
"endpoint_name=biliar... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 8.57 | 7.8 | 0.77 | 5.5845 | {
"nontransfer": 0.06778745850313705,
"transfer": 0.932212541496863
} | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | L4 | continuous | {
"calibration_sha256": "13f33377c33a07d1b94973183adf82613c4b9458c606175e723190967780e412",
"groups": {
"assay_concept": "L4",
"measurement_kind": "continuous",
"query_condition_group": "[\"dili_v3\",\"biliary_secretion_or_bile_flow\",\"\\u00b5L/min/100 g body weight\",\"__unknown__\",\"bile flow\",\"L4... | 0.77 | 0.137882 | 0.932213 | 5.5845 | 0.932213 | 0.067787 | safety_canonical_v27 | 1 | true | 0.075 | -1 | -1 | -1 | indirect_record | ["dili_v3","biliary_secretion_or_bile_flow","\u00b5L/min/100 g body weight","__unknown__","bile flow","L4"] | MUBZPKHOEPUJKR-UHFFFAOYSA-N | SGIWFELWJPNFDH-UHFFFAOYSA-N | parent:MUBZPKHOEPUJKR-UHFFFAOYSA-N | O=S(=O)(Nc1ccccc1)c1ccccc1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "8.57",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 8.57,
"aggregate_max": 8.57,
"aggregate_q1... | {
"aggregation_method": "individual_record",
"display_measurement_text": "7.8",
"display_unit_text": "µL/min/100 g body weight",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 7.8,
"aggregate_max": 7.8,
"aggregate_q1": ... | 17 | 17 | 14 | id | train_exact_bucket.v27_safety | identity | {"assay_format":"in_vivo_animal","biological_system_context":"Rat (Rattus norvegicus) in vivo with biliary collection; co-infused bile salts given intravenously; metabolically competent intact system.","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.85,"effect_directi... | {"assay_format":"in_vivo_animal","biological_system_context":"Male C57BL/6J mice, 2-3 months old, in vivo; metabolic competence: intact in vivo (intrinsically competent)","canonical_assay_context":"bile flow","canonical_measurement_scale_id":"__unknown__","confidence":0.9,"effect_direction":"no_change","endpoint_metric... | L4 | gold_v1 | sr_1e5923f03ece45689f88a1bd7f47a771 | sr_6140b053a4284068ba3638c97504989b | ["dili_v3","biliary_secretion_or_bile_flow","µL/min/100 g body weight","__unknown__","bile flow"] |
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