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=[N+]([O-])c1c(O)ccc2c1[nH]c1ccccc12</SMILES>
- Canonical assay context: Ames test (Salmonella Typhimurium TA98)
- Canonical measurement scale id: ames_mutagenicity_ordinal.v1
... | (B) | train | 0128aed5d37b3ebfdf8dbcf619c7ee61bf47fa807c1a37a9af4610a9464bf328 | -1 | null | -1 | null | null | null | ames | mutagenicity_outcomes | limited_balanced_parent_morgan_first.v28_safety | ames:d466098bf2c413330b82a1b544c00b8144d36399fc21d78285a5a5e85c09d051 | ames:f77be529438d326257ebee4f6663727a5b1b30af144669073e861519d3e8927b | ames:d466098bf2c413330b82a1b544c00b8144d36399fc21d78285a5a5e85c09d051 | ames:f77be529438d326257ebee4f6663727a5b1b30af144669073e861519d3e8927b | ZYNHZTIMNJKVLK-UHFFFAOYSA-N | IGIBRGBZTUXOCT-UHFFFAOYSA-N | O=[N+]([O-])c1ccc2[nH]c3ccccc3c2c1 | O=[N+]([O-])c1c(O)ccc2c1[nH]c1ccccc12 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Ames test (Salmonella Typhimurium TA98)","L1"] | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Ames test (Salmonella Typhimurium TA98)","L1"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"canonical_assay_context=Ames test (Salmonella Typhimurium TA98)",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=in_vitro",
"metabolic_ac... | [
"canonical_assay_context=Ames test (Salmonella Typhimurium TA98)",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=in_vitro",
"metabolic_ac... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 2 | 0 | 2 | 1.102822 | {
"nontransfer": 0.9999992736942285,
"transfer": 7.263057714794473e-7
} | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Ames test (Salmonella Typhimurium TA98)","L1"] | L1 | ordinal | {
"calibration_sha256": "6247b4348c45aae52af4abc28a4bc3df331a81fb6e022d4f3e9ceaf6f6844428",
"groups": {
"assay_concept": "L1",
"measurement_kind": "ordinal",
"query_condition_group": "[\"mutagenicity_outcomes\",\"bacterial_reverse_mutation\",\"ordinal_outcome_class\",\"ames_mutagenicity_ordinal.v1\",\"A... | 2 | 1.813529 | 0.000001 | 1.102822 | 0.000001 | 0.999999 | safety_canonical_v27 | 0 | true | 0.463415 | -1 | -1 | -1 | indirect_record | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Ames test (Salmonella Typhimurium TA98)","L1"] | ZYNHZTIMNJKVLK-UHFFFAOYSA-N | IGIBRGBZTUXOCT-UHFFFAOYSA-N | c1ccc2c(c1)[nH]c1ccccc12 | c1ccc2c(c1)[nH]c1ccccc12 | {
"aggregation_method": "individual_record",
"display_measurement_text": "2",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2,
"aggregate_max": 2,
"aggregate_q1": 2,
"agg... | {
"aggregation_method": "individual_record",
"display_measurement_text": "0",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 0,
"aggregate_max": 0,
"aggregate_q1": 0,
"agg... | 83 | 75 | 74 | id | train_exact_bucket.v27_safety | identity | {"canonical_assay_context":"Ames test (Salmonella Typhimurium TA98)","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.85,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimental_context":"in_vitro","ext... | {"canonical_assay_context":"Ames test (Salmonella Typhimurium TA98)","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.8,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimental_context":"in_vitro","extr... | L1 | gold_v1 | sr_55c842defb7145e0aff16fd155f6e803 | sr_21dbe824159242dfb64afd80fb8a2bc8 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Ames test (Salmonella Typhimurium TA98)"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>C=CC(OCC)OCC</SMILES>
- Canonical assay context: bacterial reverse mutation (Ames) in Salmonella Typhimurium TA1535
- Canonical measurement scale id: ames_mutagenicity_ordinal.v... | (A) | train | 47907324c9559b33d08254ca491b70492ed5f5850e57418a84f82cb6dbe5e124 | -1 | null | -1 | null | null | null | ames | mutagenicity_outcomes | limited_balanced_parent_morgan_first.v28_safety | ames:23d1b6a7d874ce429e04ba9553283bff945ae1af31d58582e99d22738f599cde | ames:054db30d34840e62709cddc309bc53dfe89ebf83fedc8635a47725dcbc7fc68c | ames:23d1b6a7d874ce429e04ba9553283bff945ae1af31d58582e99d22738f599cde | ames:054db30d34840e62709cddc309bc53dfe89ebf83fedc8635a47725dcbc7fc68c | NLHHRLWOUZZQLW-UHFFFAOYSA-N | MCIPQLOKVXSHTD-UHFFFAOYSA-N | C=CC#N | C=CC(OCC)OCC | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA1535","L1"] | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA1535","L1"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"canonical_assay_context=bacterial reverse mutation (Ames) in Salmonella Typhimurium TA1535",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context... | [
"canonical_assay_context=bacterial reverse mutation (Ames) in Salmonella Typhimurium TA1535",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 0 | 0 | 0 | 1.129189 | {
"nontransfer": 0.01798620996209155,
"transfer": 0.9820137900379085
} | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA1535","L1"] | L1 | ordinal | {
"calibration_sha256": "6247b4348c45aae52af4abc28a4bc3df331a81fb6e022d4f3e9ceaf6f6844428",
"groups": {
"assay_concept": "L1",
"measurement_kind": "ordinal",
"query_condition_group": "[\"mutagenicity_outcomes\",\"bacterial_reverse_mutation\",\"ordinal_outcome_class\",\"ames_mutagenicity_ordinal.v1\",\"b... | 0 | 0 | 0.982014 | 1.129189 | 0.982014 | 0.017986 | safety_canonical_v27 | 1 | true | 0.136364 | -1 | -1 | -1 | indirect_record | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA1535","L1"] | NLHHRLWOUZZQLW-UHFFFAOYSA-N | MCIPQLOKVXSHTD-UHFFFAOYSA-N | parent:NLHHRLWOUZZQLW-UHFFFAOYSA-N | parent:MCIPQLOKVXSHTD-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "0",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 0,
"aggregate_max": 0,
"aggregate_q1": 0,
"agg... | {
"aggregation_method": "individual_record",
"display_measurement_text": "0",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 0,
"aggregate_max": 0,
"aggregate_q1": 0,
"agg... | 84 | 82 | 73 | id | train_exact_bucket.v27_safety | identity | {"canonical_assay_context":"bacterial reverse mutation (Ames) in Salmonella Typhimurium TA1535","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.9,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimenta... | {"canonical_assay_context":"bacterial reverse mutation (Ames) in Salmonella Typhimurium TA1535","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.9,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimenta... | L1 | gold_v1 | sr_5cfcaa0dbf03409c89055dc91f8864ae | sr_69f9dfe48c27497dafc95fac1b8e0bc6 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA1535"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>c1ccc2c(c1)ccc1cc3c(ccc4ccccc43)cc12</SMILES>
- Canonical assay context: bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100
- Canonical measurement scale id: ames... | (B) | train | d00e24086d198e0d5c54dd077cb3a3db0a4d9076d0777cc8421157425712ad73 | -1 | null | -1 | null | null | null | ames | mutagenicity_outcomes | limited_balanced_parent_morgan_first.v28_safety | ames:39efc954f75958e4ff1277ec26e8c82edb49e639b8e165e62c3d6a8f6297af7d | ames:19954415b131a3703116e6ae6080a56539e61496f304711b71dd46ca237d2f7f | ames:39efc954f75958e4ff1277ec26e8c82edb49e639b8e165e62c3d6a8f6297af7d | ames:19954415b131a3703116e6ae6080a56539e61496f304711b71dd46ca237d2f7f | KIVUHCNVDWYUNP-UHFFFAOYSA-N | LHRCREOYAASXPZ-UHFFFAOYSA-N | Nc1cc2c3ccccc3ccc2c2ccccc12 | c1ccc2c(c1)ccc1cc3c(ccc4ccccc43)cc12 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","L1"] | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","L1"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"canonical_assay_context=bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=... | [
"canonical_assay_context=bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 2 | 0 | 2 | 0.916948 | {
"nontransfer": 0.99999998161063,
"transfer": 1.8389369974017237e-8
} | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","L1"] | L1 | ordinal | {
"calibration_sha256": "6247b4348c45aae52af4abc28a4bc3df331a81fb6e022d4f3e9ceaf6f6844428",
"groups": {
"assay_concept": "L1",
"measurement_kind": "ordinal",
"query_condition_group": "[\"mutagenicity_outcomes\",\"bacterial_reverse_mutation\",\"ordinal_outcome_class\",\"ames_mutagenicity_ordinal.v1\",\"b... | 2 | 2.181149 | 0 | 0.916948 | 0 | 1 | safety_canonical_v27 | 0 | true | 0.52 | -1 | -1 | -1 | indirect_record | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","L1"] | KIVUHCNVDWYUNP-UHFFFAOYSA-N | LHRCREOYAASXPZ-UHFFFAOYSA-N | c1ccc2c(c1)ccc1c3ccccc3ccc21 | c1ccc2c(c1)ccc1cc3c(ccc4ccccc43)cc12 | {
"aggregation_method": "individual_record",
"display_measurement_text": "2",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2,
"aggregate_max": 2,
"aggregate_q1": 2,
"agg... | {
"aggregation_method": "individual_record",
"display_measurement_text": "0",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 0,
"aggregate_max": 0,
"aggregate_q1": 0,
"agg... | 257 | 239 | 201 | id | train_exact_bucket.v27_safety | identity | {"canonical_assay_context":"bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.9,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimental... | {"canonical_assay_context":"bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.8,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimental... | L1 | gold_v1 | sr_7b9ae0d477394c6a96818b95ad474a6a | sr_12f97442e3f74d7289b2b9715287df11 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>ClC(Cl)Cl</SMILES>
- Canonical assay context: bacterial reverse mutation (Ames) in Salmonella Typhimurium TA1535
- Canonical measurement scale id: ames_mutagenicity_ordinal.v1
-... | (B) | train | 792f6fb89f520f725fe402ab78946646b6098ebb520fe220045950feeb5cae54 | -1 | null | -1 | null | null | null | ames | mutagenicity_outcomes | limited_balanced_parent_morgan_first.v28_safety | ames:86a2128456c32114c9d5475eed30cf049db76ddbae56152fa7903fc0bf5d8f16 | ames:583520f47ea7285cbdec47324179dad0278cc6606e390f1c433c8789cd437764 | ames:86a2128456c32114c9d5475eed30cf049db76ddbae56152fa7903fc0bf5d8f16 | ames:583520f47ea7285cbdec47324179dad0278cc6606e390f1c433c8789cd437764 | VOPWNXZWBYDODV-UHFFFAOYSA-N | HEDRZPFGACZZDS-UHFFFAOYSA-N | FC(F)Cl | ClC(Cl)Cl | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA1535","L1"] | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA1535","L1"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"canonical_assay_context=bacterial reverse mutation (Ames) in Salmonella Typhimurium TA1535",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context... | [
"canonical_assay_context=bacterial reverse mutation (Ames) in Salmonella Typhimurium TA1535",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 2 | 0 | 2 | 1.129189 | {
"nontransfer": 0.9999988907519922,
"transfer": 0.000001109248007819857
} | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA1535","L1"] | L1 | ordinal | {
"calibration_sha256": "6247b4348c45aae52af4abc28a4bc3df331a81fb6e022d4f3e9ceaf6f6844428",
"groups": {
"assay_concept": "L1",
"measurement_kind": "ordinal",
"query_condition_group": "[\"mutagenicity_outcomes\",\"bacterial_reverse_mutation\",\"ordinal_outcome_class\",\"ames_mutagenicity_ordinal.v1\",\"b... | 2 | 1.771183 | 0.000001 | 1.129189 | 0.000001 | 0.999999 | safety_canonical_v27 | 0 | true | 0.428571 | -1 | -1 | -1 | indirect_record | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA1535","L1"] | VOPWNXZWBYDODV-UHFFFAOYSA-N | HEDRZPFGACZZDS-UHFFFAOYSA-N | parent:VOPWNXZWBYDODV-UHFFFAOYSA-N | parent:HEDRZPFGACZZDS-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "2",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2,
"aggregate_max": 2,
"aggregate_q1": 2,
"agg... | {
"aggregation_method": "individual_record",
"display_measurement_text": "0",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 0,
"aggregate_max": 0,
"aggregate_q1": 0,
"agg... | 84 | 82 | 73 | id | train_exact_bucket.v27_safety | identity | {"canonical_assay_context":"bacterial reverse mutation (Ames) in Salmonella Typhimurium TA1535","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.9,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimenta... | {"canonical_assay_context":"bacterial reverse mutation (Ames) in Salmonella Typhimurium TA1535","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.9,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimenta... | L1 | gold_v1 | sr_f28db8ba80704b9e98a62e9644defa7e | sr_c6dca3c0dde24e4780aa6fe26eb7f488 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA1535"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>c1ccc2c(c1)ccc1cc3c(ccc4ccccc43)cc12</SMILES>
- Canonical assay context: bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100
- Canonical measurement scale id: ames... | (A) | train | e1d1a2a91b3245a9e781feb8855cc636467c8ea24adb61380d72526a25c2993e | -1 | null | -1 | null | null | null | ames | mutagenicity_outcomes | limited_balanced_parent_morgan_first.v28_safety | ames:79bf7f8d9486899504dbc3885db7177a467c0b7e2c584f7759f95cc85a1cff55 | ames:19954415b131a3703116e6ae6080a56539e61496f304711b71dd46ca237d2f7f | ames:79bf7f8d9486899504dbc3885db7177a467c0b7e2c584f7759f95cc85a1cff55 | ames:19954415b131a3703116e6ae6080a56539e61496f304711b71dd46ca237d2f7f | DXBHBZVCASKNBY-UHFFFAOYSA-N | LHRCREOYAASXPZ-UHFFFAOYSA-N | c1ccc2cc3c(ccc4ccccc43)cc2c1 | c1ccc2c(c1)ccc1cc3c(ccc4ccccc43)cc12 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","L1"] | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","L1"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"canonical_assay_context=bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=... | [
"canonical_assay_context=bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 0 | 0 | 0 | 0.916948 | {
"nontransfer": 0.01798620996209155,
"transfer": 0.9820137900379085
} | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","L1"] | L1 | ordinal | {
"calibration_sha256": "6247b4348c45aae52af4abc28a4bc3df331a81fb6e022d4f3e9ceaf6f6844428",
"groups": {
"assay_concept": "L1",
"measurement_kind": "ordinal",
"query_condition_group": "[\"mutagenicity_outcomes\",\"bacterial_reverse_mutation\",\"ordinal_outcome_class\",\"ames_mutagenicity_ordinal.v1\",\"b... | 0 | 0 | 0.982014 | 0.916948 | 0.982014 | 0.017986 | safety_canonical_v27 | 1 | true | 0.888889 | -1 | -1 | -1 | indirect_record | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","L1"] | DXBHBZVCASKNBY-UHFFFAOYSA-N | LHRCREOYAASXPZ-UHFFFAOYSA-N | c1ccc2cc3c(ccc4ccccc43)cc2c1 | c1ccc2c(c1)ccc1cc3c(ccc4ccccc43)cc12 | {
"aggregation_method": "individual_record",
"display_measurement_text": "0",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 0,
"aggregate_max": 0,
"aggregate_q1": 0,
"agg... | {
"aggregation_method": "individual_record",
"display_measurement_text": "0",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 0,
"aggregate_max": 0,
"aggregate_q1": 0,
"agg... | 257 | 239 | 201 | id | train_exact_bucket.v27_safety | identity | {"canonical_assay_context":"bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.9,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimental... | {"canonical_assay_context":"bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.8,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimental... | L1 | gold_v1 | sr_4ff15f1e1d8348a09d3b0e3a840d820a | sr_12f97442e3f74d7289b2b9715287df11 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]</SMILES>
- Canonical assay context: bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98
- Canonical measurement scale id: ames_m... | (B) | train | 045303bd70afc728304dacfa9480b07dbe40f2697f7c37171af434f259d73bd5 | -1 | null | -1 | null | null | null | ames | mutagenicity_outcomes | limited_balanced_parent_morgan_first.v28_safety | ames:3a40246937b3d5c5235951ca60164dfa75bacf654370fe2c1e99f472a113fd03 | ames:6f185556560b53b649ae56ccffae1b639518aeefbcecf6d12d95ffc3172628bc | ames:3a40246937b3d5c5235951ca60164dfa75bacf654370fe2c1e99f472a113fd03 | ames:6f185556560b53b649ae56ccffae1b639518aeefbcecf6d12d95ffc3172628bc | TYMLOMAKGOJONV-UHFFFAOYSA-N | RMBFBMJGBANMMK-UHFFFAOYSA-N | Nc1ccc([N+](=O)[O-])cc1 | Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98","L1"] | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98","L1"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"canonical_assay_context=bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=i... | [
"canonical_assay_context=bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=i... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 2 | 0 | 2 | 1.065728 | {
"nontransfer": 0.9999996136457107,
"transfer": 3.8635428939011824e-7
} | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98","L1"] | L1 | ordinal | {
"calibration_sha256": "6247b4348c45aae52af4abc28a4bc3df331a81fb6e022d4f3e9ceaf6f6844428",
"groups": {
"assay_concept": "L1",
"measurement_kind": "ordinal",
"query_condition_group": "[\"mutagenicity_outcomes\",\"bacterial_reverse_mutation\",\"ordinal_outcome_class\",\"ames_mutagenicity_ordinal.v1\",\"b... | 2 | 1.876651 | 0 | 1.065728 | 0 | 1 | safety_canonical_v27 | 0 | true | 0.413793 | -1 | -1 | -1 | indirect_record | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98","L1"] | TYMLOMAKGOJONV-UHFFFAOYSA-N | RMBFBMJGBANMMK-UHFFFAOYSA-N | c1ccccc1 | c1ccccc1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "2",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2,
"aggregate_max": 2,
"aggregate_q1": 2,
"agg... | {
"aggregation_method": "individual_record",
"display_measurement_text": "0",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 0,
"aggregate_max": 0,
"aggregate_q1": 0,
"agg... | 209 | 167 | 153 | id | train_exact_bucket.v27_safety | identity | {"canonical_assay_context":"bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.9,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimental_... | {"canonical_assay_context":"bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.9,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimental_... | L1 | gold_v1 | sr_eb1d174bbb9a46e19f9ed006e689a63c | sr_0ea217af1ce04310b6defb61e94bfbc0 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>Nc1ccc(N)c(N)c1</SMILES>
- Canonical assay context: Ames test (Salmonella Typhimurium TA98)
- Canonical measurement scale id: ames_mutagenicity_ordinal.v1
- Chemical entity type... | (A) | train | 97f4056870691b64fb1189cde1761cbe0ef32593ce75df14a3b2dc6309180bfa | -1 | null | -1 | null | null | null | ames | mutagenicity_outcomes | limited_balanced_parent_morgan_first.v28_safety | ames:3708e5892f1e3be0866ce624206deaf1bf7e7c503996ee79c30eb5ea46897c77 | ames:28e307fb51bd9bf9a57a968d7a059e4941e2208b1b878fac90389f037d7d794f | ames:3708e5892f1e3be0866ce624206deaf1bf7e7c503996ee79c30eb5ea46897c77 | ames:28e307fb51bd9bf9a57a968d7a059e4941e2208b1b878fac90389f037d7d794f | CBCKQZAAMUWICA-UHFFFAOYSA-N | JSYBAZQQYCNZJE-UHFFFAOYSA-N | Nc1ccc(N)cc1 | Nc1ccc(N)c(N)c1 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Ames test (Salmonella Typhimurium TA98)","L1"] | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Ames test (Salmonella Typhimurium TA98)","L1"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"canonical_assay_context=Ames test (Salmonella Typhimurium TA98)",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=in_vitro",
"metabolic_ac... | [
"canonical_assay_context=Ames test (Salmonella Typhimurium TA98)",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=in_vitro",
"metabolic_ac... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 2 | 2 | 0 | 1.102822 | {
"nontransfer": 0.01798620996209155,
"transfer": 0.9820137900379085
} | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Ames test (Salmonella Typhimurium TA98)","L1"] | L1 | ordinal | {
"calibration_sha256": "6247b4348c45aae52af4abc28a4bc3df331a81fb6e022d4f3e9ceaf6f6844428",
"groups": {
"assay_concept": "L1",
"measurement_kind": "ordinal",
"query_condition_group": "[\"mutagenicity_outcomes\",\"bacterial_reverse_mutation\",\"ordinal_outcome_class\",\"ames_mutagenicity_ordinal.v1\",\"A... | 0 | 0 | 0.982014 | 1.102822 | 0.982014 | 0.017986 | safety_canonical_v27 | 1 | true | 0.466667 | -1 | -1 | -1 | indirect_record | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Ames test (Salmonella Typhimurium TA98)","L1"] | CBCKQZAAMUWICA-UHFFFAOYSA-N | JSYBAZQQYCNZJE-UHFFFAOYSA-N | c1ccccc1 | c1ccccc1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "2",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2,
"aggregate_max": 2,
"aggregate_q1": 2,
"agg... | {
"aggregation_method": "individual_record",
"display_measurement_text": "2",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2,
"aggregate_max": 2,
"aggregate_q1": 2,
"agg... | 83 | 75 | 74 | id | train_exact_bucket.v27_safety | identity | {"canonical_assay_context":"Ames test (Salmonella Typhimurium TA98)","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.9,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimental_context":"in_vitro","extr... | {"canonical_assay_context":"Ames test (Salmonella Typhimurium TA98)","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.85,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimental_context":"in_vitro","ext... | L1 | gold_v1 | sr_1c6e3698caf744929ff1508a1ee74e8d | sr_d18e9ac9dcf343e5bb70df1f409706f1 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Ames test (Salmonella Typhimurium TA98)"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>Cc1cc2ccccc2c2cc([N+](=O)[O-])c3ccccc3c12</SMILES>
- Canonical assay context: bacterial reverse mutation (Salmonella Typhimurium TA98/TA100)
- Canonical measurement scale id: am... | (B) | train | 2d668ad343ecebeb76dd3c942069d80789d844ba1204277a5b630e335a512c13 | -1 | null | -1 | null | null | null | ames | mutagenicity_outcomes | limited_balanced_parent_morgan_first.v28_safety | ames:2f9567f256faa935aabab129927673c3bd188e1025cbeca0437ca612b77aa365 | ames:685dd419d50eff201bdb437f385a3db092c557c46f5f2e215dcb6fc11a0d165a | ames:2f9567f256faa935aabab129927673c3bd188e1025cbeca0437ca612b77aa365 | ames:685dd419d50eff201bdb437f385a3db092c557c46f5f2e215dcb6fc11a0d165a | GOHBXWHNJHENRX-UHFFFAOYSA-N | OMBRRTHRPGDGPK-UHFFFAOYSA-N | Cc1cc2ccccc2c2ccc3ccccc3c12 | Cc1cc2ccccc2c2cc([N+](=O)[O-])c3ccccc3c12 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Salmonella Typhimurium TA98/TA100)","L1"] | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Salmonella Typhimurium TA98/TA100)","L1"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"canonical_assay_context=bacterial reverse mutation (Salmonella Typhimurium TA98/TA100)",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=in_... | [
"canonical_assay_context=bacterial reverse mutation (Salmonella Typhimurium TA98/TA100)",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=in_... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 0 | 2 | 2 | 1.103301 | {
"nontransfer": 0.999999267954324,
"transfer": 7.320456759839014e-7
} | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Salmonella Typhimurium TA98/TA100)","L1"] | L1 | ordinal | {
"calibration_sha256": "6247b4348c45aae52af4abc28a4bc3df331a81fb6e022d4f3e9ceaf6f6844428",
"groups": {
"assay_concept": "L1",
"measurement_kind": "ordinal",
"query_condition_group": "[\"mutagenicity_outcomes\",\"bacterial_reverse_mutation\",\"ordinal_outcome_class\",\"ames_mutagenicity_ordinal.v1\",\"b... | 2 | 1.812742 | 0.000001 | 1.103301 | 0.000001 | 0.999999 | safety_canonical_v27 | 0 | true | 0.571429 | -1 | -1 | -1 | indirect_record | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Salmonella Typhimurium TA98/TA100)","L1"] | GOHBXWHNJHENRX-UHFFFAOYSA-N | OMBRRTHRPGDGPK-UHFFFAOYSA-N | c1ccc2c(c1)ccc1c3ccccc3ccc21 | c1ccc2c(c1)ccc1c3ccccc3ccc21 | {
"aggregation_method": "individual_record",
"display_measurement_text": "0",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 0,
"aggregate_max": 0,
"aggregate_q1": 0,
"agg... | {
"aggregation_method": "individual_record",
"display_measurement_text": "2",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2,
"aggregate_max": 2,
"aggregate_q1": 2,
"agg... | 126 | 100 | 92 | id | train_exact_bucket.v27_safety | identity | {"canonical_assay_context":"bacterial reverse mutation (Salmonella Typhimurium TA98/TA100)","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.9,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimental_co... | {"canonical_assay_context":"bacterial reverse mutation (Salmonella Typhimurium TA98/TA100)","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.93,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimental_c... | L1 | gold_v1 | sr_cdb8a98398084dc4a92fbf52ff77833e | sr_8393dfe37ab34312bd6af333d84a91cb | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Salmonella Typhimurium TA98/TA100)"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>O=[N+]([O-])c1ccc(Sc2ccccc2)cc1</SMILES>
- Canonical assay context: Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98
- Canonical measurement scale id: ames_mutag... | (A) | train | 50222b3d5ba66d2d614172e3344e9d2e6448fff2ae5d3b4148ef8f840769b548 | -1 | null | -1 | null | null | null | ames | mutagenicity_outcomes | limited_balanced_parent_morgan_first.v28_safety | ames:8ab5cffdfe1de4dfb74c7e1e1245778da4e627a39c6cc144ab0a624e3937ec9b | ames:99e0cb706823dbd1547fa990e5935161756f40d67c9cb2c7794dcc2945233069 | ames:8ab5cffdfe1de4dfb74c7e1e1245778da4e627a39c6cc144ab0a624e3937ec9b | ames:99e0cb706823dbd1547fa990e5935161756f40d67c9cb2c7794dcc2945233069 | RQCGYFGYSRBVDU-UHFFFAOYSA-N | RJCBYBQJVXVVKB-UHFFFAOYSA-N | CC(=O)ON(C(C)=O)c1ccc(Sc2ccccc2)cc1 | O=[N+]([O-])c1ccc(Sc2ccccc2)cc1 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98","L1"] | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98","L1"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"canonical_assay_context=Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=i... | [
"canonical_assay_context=Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=i... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 2 | 2 | 0 | 0.782226 | {
"nontransfer": 0.01798620996209155,
"transfer": 0.9820137900379085
} | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98","L1"] | L1 | ordinal | {
"calibration_sha256": "6247b4348c45aae52af4abc28a4bc3df331a81fb6e022d4f3e9ceaf6f6844428",
"groups": {
"assay_concept": "L1",
"measurement_kind": "ordinal",
"query_condition_group": "[\"mutagenicity_outcomes\",\"bacterial_reverse_mutation\",\"ordinal_outcome_class\",\"ames_mutagenicity_ordinal.v1\",\"B... | 0 | 0 | 0.982014 | 0.782226 | 0.982014 | 0.017986 | safety_canonical_v27 | 1 | true | 0.35 | -1 | -1 | -1 | indirect_record | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98","L1"] | RQCGYFGYSRBVDU-UHFFFAOYSA-N | RJCBYBQJVXVVKB-UHFFFAOYSA-N | c1ccc(Sc2ccccc2)cc1 | c1ccc(Sc2ccccc2)cc1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "2",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2,
"aggregate_max": 2,
"aggregate_q1": 2,
"agg... | {
"aggregation_method": "individual_record",
"display_measurement_text": "2",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2,
"aggregate_max": 2,
"aggregate_q1": 2,
"agg... | 379 | 263 | 166 | id | train_exact_bucket.v27_safety | identity | {"canonical_assay_context":"Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.7,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimental_... | {"canonical_assay_context":"Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.9,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimental_... | L1 | gold_v1 | sr_fd3025e6f1314ec3ac00154adc1ec148 | sr_dc60167fa035449487301838cf6166e2 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>COc1ccc2cc([C@H](C)C(=O)O)ccc2c1</SMILES>
- Canonical assay context: Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98
- Canonical measurement scale id: ames_muta... | (A) | train | c78547eeab7ffd428c236d0578f1cfb9b433cb113a82e6c8d40e2b30dae358da | -1 | null | -1 | null | null | null | ames | mutagenicity_outcomes | limited_balanced_parent_morgan_first.v28_safety | ames:1b79526690ad129a5dcb73d9cdf9ae641ab2b1bd5628025abd7f75682919d75a | ames:b50da77df619d10886f781ef6cdd234c58fb081065da53acbb361da42125c963 | ames:1b79526690ad129a5dcb73d9cdf9ae641ab2b1bd5628025abd7f75682919d75a | ames:b50da77df619d10886f781ef6cdd234c58fb081065da53acbb361da42125c963 | APKHJGDGWQDBGM-UHFFFAOYSA-N | CMWTZPSULFXXJA-VIFPVBQESA-N | COc1cc2nc(N3CCNCC3)nc(N)c2cc1OC | COc1ccc2cc([C@H](C)C(=O)O)ccc2c1 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98","L1"] | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98","L1"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"canonical_assay_context=Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=i... | [
"canonical_assay_context=Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=i... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 0 | 0 | 0 | 0.782226 | {
"nontransfer": 0.01798620996209155,
"transfer": 0.9820137900379085
} | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98","L1"] | L1 | ordinal | {
"calibration_sha256": "6247b4348c45aae52af4abc28a4bc3df331a81fb6e022d4f3e9ceaf6f6844428",
"groups": {
"assay_concept": "L1",
"measurement_kind": "ordinal",
"query_condition_group": "[\"mutagenicity_outcomes\",\"bacterial_reverse_mutation\",\"ordinal_outcome_class\",\"ames_mutagenicity_ordinal.v1\",\"B... | 0 | 0 | 0.982014 | 0.782226 | 0.982014 | 0.017986 | safety_canonical_v27 | 1 | true | 0.137931 | -1 | -1 | -1 | indirect_record | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98","L1"] | APKHJGDGWQDBGM-UHFFFAOYSA-N | CMWTZPSULFXXJA-VIFPVBQESA-N | c1ccc2nc(N3CCNCC3)ncc2c1 | c1ccc2ccccc2c1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "0",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 0,
"aggregate_max": 0,
"aggregate_q1": 0,
"agg... | {
"aggregation_method": "individual_record",
"display_measurement_text": "0",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 0,
"aggregate_max": 0,
"aggregate_q1": 0,
"agg... | 379 | 263 | 166 | id | train_exact_bucket.v27_safety | identity | {"canonical_assay_context":"Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.9,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimental_... | {"canonical_assay_context":"Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.85,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimental... | L1 | gold_v1 | sr_300c39f1b6a74b0ba0e277cddc150b87 | sr_c41d2aa0ebc04787b7e158d633ad8c49 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>O=[N+]([O-])c1ccc(-c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c([N+](=O)[O-])c1</SMILES>
- Canonical assay context: Ames test (Salmonella Typhimurium TA98)
- Canonical measurement scale... | (A) | train | 179d31bac28f5e23c9dbf08f75b3a9e7ad81f49b7f772398740c2a39d8f6157c | -1 | null | -1 | null | null | null | ames | mutagenicity_outcomes | limited_balanced_parent_morgan_first.v28_safety | ames:9397e716cce1bedba7f9b1634feca06a6e805efc852d91f3d3cec4866e2c0a36 | ames:af435ab7645f9e7c220895f55e745ce29b87ad160487d5cefe0aa17cf2deed50 | ames:9397e716cce1bedba7f9b1634feca06a6e805efc852d91f3d3cec4866e2c0a36 | ames:af435ab7645f9e7c220895f55e745ce29b87ad160487d5cefe0aa17cf2deed50 | GVBHRNIWBGTNQA-UHFFFAOYSA-N | UDJCKALRMXKDIT-UHFFFAOYSA-N | COc1cc([N+](=O)[O-])ccc1N | O=[N+]([O-])c1ccc(-c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c([N+](=O)[O-])c1 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Ames test (Salmonella Typhimurium TA98)","L1"] | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Ames test (Salmonella Typhimurium TA98)","L1"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"canonical_assay_context=Ames test (Salmonella Typhimurium TA98)",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=in_vitro",
"metabolic_ac... | [
"canonical_assay_context=Ames test (Salmonella Typhimurium TA98)",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=in_vitro",
"metabolic_ac... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 2 | 2 | 0 | 1.102822 | {
"nontransfer": 0.01798620996209155,
"transfer": 0.9820137900379085
} | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Ames test (Salmonella Typhimurium TA98)","L1"] | L1 | ordinal | {
"calibration_sha256": "6247b4348c45aae52af4abc28a4bc3df331a81fb6e022d4f3e9ceaf6f6844428",
"groups": {
"assay_concept": "L1",
"measurement_kind": "ordinal",
"query_condition_group": "[\"mutagenicity_outcomes\",\"bacterial_reverse_mutation\",\"ordinal_outcome_class\",\"ames_mutagenicity_ordinal.v1\",\"A... | 0 | 0 | 0.982014 | 1.102822 | 0.982014 | 0.017986 | safety_canonical_v27 | 1 | true | 0.424242 | -1 | -1 | -1 | indirect_record | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Ames test (Salmonella Typhimurium TA98)","L1"] | GVBHRNIWBGTNQA-UHFFFAOYSA-N | UDJCKALRMXKDIT-UHFFFAOYSA-N | c1ccccc1 | c1ccc(-c2ccccc2)cc1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "2",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2,
"aggregate_max": 2,
"aggregate_q1": 2,
"agg... | {
"aggregation_method": "individual_record",
"display_measurement_text": "2",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2,
"aggregate_max": 2,
"aggregate_q1": 2,
"agg... | 83 | 75 | 74 | id | train_exact_bucket.v27_safety | identity | {"canonical_assay_context":"Ames test (Salmonella Typhimurium TA98)","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.9,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimental_context":"in_vitro","extr... | {"canonical_assay_context":"Ames test (Salmonella Typhimurium TA98)","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.55,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimental_context":"in_vitro","ext... | L1 | gold_v1 | sr_4db60f560ca44c4fbc64f835e5f10518 | sr_08cba0770141412498c315edf6cb4e86 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Ames test (Salmonella Typhimurium TA98)"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>CC(=O)Nc1ccc(-c2ccc(N)cc2)cc1</SMILES>
- Canonical assay context: Bacterial reverse mutation (Ames) in Salmonella; strains: TA98, TA100
- Canonical measurement scale id: ames_mu... | (B) | train | e3e078d79d962dc3571cad1952f6d24939776b47285f7c1719c24d128606485d | -1 | null | -1 | null | null | null | ames | mutagenicity_outcomes | limited_balanced_parent_morgan_first.v28_safety | ames:99b22f64fcd617306556f07d043289c894a8c3a0540940729f14b3dd3eda2576 | ames:01582fc48df08ac7025571360f6e2f2b0091df3e44a211cb065ad0f3a1337a57 | ames:99b22f64fcd617306556f07d043289c894a8c3a0540940729f14b3dd3eda2576 | ames:01582fc48df08ac7025571360f6e2f2b0091df3e44a211cb065ad0f3a1337a57 | HFACYLZERDEVSX-UHFFFAOYSA-N | DZQXBXZZSKPMDV-UHFFFAOYSA-N | Nc1ccc(-c2ccc(N)cc2)cc1 | CC(=O)Nc1ccc(-c2ccc(N)cc2)cc1 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella; strains: TA98, TA100","L1"] | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella; strains: TA98, TA100","L1"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"canonical_assay_context=Bacterial reverse mutation (Ames) in Salmonella; strains: TA98, TA100",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_cont... | [
"canonical_assay_context=Bacterial reverse mutation (Ames) in Salmonella; strains: TA98, TA100",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_cont... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 2 | 3 | 1 | 0.606092 | {
"nontransfer": 0.9999962702224251,
"transfer": 0.0000037297775749374376
} | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella; strains: TA98, TA100","L1"] | L1 | ordinal | {
"calibration_sha256": "6247b4348c45aae52af4abc28a4bc3df331a81fb6e022d4f3e9ceaf6f6844428",
"groups": {
"assay_concept": "L1",
"measurement_kind": "ordinal",
"query_condition_group": "[\"mutagenicity_outcomes\",\"bacterial_reverse_mutation\",\"ordinal_outcome_class\",\"ames_mutagenicity_ordinal.v1\",\"B... | 1 | 1.649916 | 0.000004 | 0.606092 | 0.000004 | 0.999996 | safety_canonical_v27 | 0 | true | 0.458333 | -1 | -1 | -1 | indirect_record | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella; strains: TA98, TA100","L1"] | HFACYLZERDEVSX-UHFFFAOYSA-N | DZQXBXZZSKPMDV-UHFFFAOYSA-N | c1ccc(-c2ccccc2)cc1 | c1ccc(-c2ccccc2)cc1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "2",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2,
"aggregate_max": 2,
"aggregate_q1": 2,
"agg... | {
"aggregation_method": "individual_record",
"display_measurement_text": "3",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 3,
"aggregate_max": 3,
"aggregate_q1": 3,
"agg... | 128 | 98 | 85 | id | train_exact_bucket.v27_safety | identity | {"canonical_assay_context":"Bacterial reverse mutation (Ames) in Salmonella; strains: TA98, TA100","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.95,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experim... | {"canonical_assay_context":"Bacterial reverse mutation (Ames) in Salmonella; strains: TA98, TA100","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.97,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experim... | L1 | gold_v1 | sr_1a88e68467f84b2b97f15db25c8861cc | sr_f9b17b29c49746b3a6f54692e8f6c521 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella; strains: TA98, TA100"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>Nc1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1</SMILES>
- Canonical assay context: bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100
- Canonical measurement scale id: ames_m... | (A) | train | e79a475902f4f1911514b63fd255b2c80c77686ce9cc690c5edcea5bb4cdf486 | -1 | null | -1 | null | null | null | ames | mutagenicity_outcomes | limited_balanced_parent_morgan_first.v28_safety | ames:bcbb537e91507f40e5e573b954cb6444aefc8942558fa35f5096146b700f541b | ames:e072f65a0eca18d8273bf15659b238f6cb148f88f2101346bd2942e973075d1d | ames:bcbb537e91507f40e5e573b954cb6444aefc8942558fa35f5096146b700f541b | ames:e072f65a0eca18d8273bf15659b238f6cb148f88f2101346bd2942e973075d1d | SVMGVZLUIWGYPH-UHFFFAOYSA-N | ZBPKGHOGUVVDLF-UHFFFAOYSA-N | O=[N+]([O-])c1ccc(Oc2ccc(N=C=S)cc2)cc1 | Nc1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","L1"] | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","L1"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"canonical_assay_context=bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=... | [
"canonical_assay_context=bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 2 | 2 | 0 | 0.916948 | {
"nontransfer": 0.01798620996209155,
"transfer": 0.9820137900379085
} | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","L1"] | L1 | ordinal | {
"calibration_sha256": "6247b4348c45aae52af4abc28a4bc3df331a81fb6e022d4f3e9ceaf6f6844428",
"groups": {
"assay_concept": "L1",
"measurement_kind": "ordinal",
"query_condition_group": "[\"mutagenicity_outcomes\",\"bacterial_reverse_mutation\",\"ordinal_outcome_class\",\"ames_mutagenicity_ordinal.v1\",\"b... | 0 | 0 | 0.982014 | 0.916948 | 0.982014 | 0.017986 | safety_canonical_v27 | 1 | true | 0.325 | -1 | -1 | -1 | indirect_record | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","L1"] | SVMGVZLUIWGYPH-UHFFFAOYSA-N | ZBPKGHOGUVVDLF-UHFFFAOYSA-N | c1ccc(Oc2ccccc2)cc1 | c1ccc(Sc2ccccc2)cc1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "2",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2,
"aggregate_max": 2,
"aggregate_q1": 2,
"agg... | {
"aggregation_method": "individual_record",
"display_measurement_text": "2",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2,
"aggregate_max": 2,
"aggregate_q1": 2,
"agg... | 257 | 239 | 201 | id | train_exact_bucket.v27_safety | identity | {"canonical_assay_context":"bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.95,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimenta... | {"canonical_assay_context":"bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.9,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimental... | L1 | gold_v1 | sr_c6a72d8788594e1ea88a493300f887d8 | sr_b2e9627271334ba59678fdbb6b45f0fd | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>O=P(O)(OCC(Br)CBr)OCC(Br)CBr</SMILES>
- Canonical assay context: bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100/TA1535
- Canonical measurement scale id: ames_... | (A) | train | 9d5dc44a4afdd49af51151918fe242baef8e7d0f1d895cc5dcad4e0873b8b75c | -1 | null | -1 | null | null | null | ames | mutagenicity_outcomes | limited_balanced_parent_morgan_first.v28_safety | ames:ea9751617afcffb99e7f24770892d6b0ea9c9e9a395b8e678b25a32beef9b847 | ames:3ce2d7a4034f46d09e088782bc17b53125333edbc2b920805ae0c9b910c15581 | ames:ea9751617afcffb99e7f24770892d6b0ea9c9e9a395b8e678b25a32beef9b847 | ames:3ce2d7a4034f46d09e088782bc17b53125333edbc2b920805ae0c9b910c15581 | XRJXLCKWXSOIAF-UHFFFAOYSA-N | CBPKIOGAUWKEFT-UHFFFAOYSA-N | Nc1nc(N)nc(N(CC(Br)CBr)CC(Br)CBr)n1 | O=P(O)(OCC(Br)CBr)OCC(Br)CBr | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100/TA1535","L1"] | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100/TA1535","L1"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"canonical_assay_context=bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100/TA1535",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_c... | [
"canonical_assay_context=bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100/TA1535",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_c... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 2 | 2 | 0 | 0.981105 | {
"nontransfer": 0.01798620996209155,
"transfer": 0.9820137900379085
} | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100/TA1535","L1"] | L1 | ordinal | {
"calibration_sha256": "6247b4348c45aae52af4abc28a4bc3df331a81fb6e022d4f3e9ceaf6f6844428",
"groups": {
"assay_concept": "L1",
"measurement_kind": "ordinal",
"query_condition_group": "[\"mutagenicity_outcomes\",\"bacterial_reverse_mutation\",\"ordinal_outcome_class\",\"ames_mutagenicity_ordinal.v1\",\"b... | 0 | 0 | 0.982014 | 0.981105 | 0.982014 | 0.017986 | safety_canonical_v27 | 1 | true | 0.210526 | -1 | -1 | -1 | indirect_record | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100/TA1535","L1"] | XRJXLCKWXSOIAF-UHFFFAOYSA-N | CBPKIOGAUWKEFT-UHFFFAOYSA-N | c1ncncn1 | parent:CBPKIOGAUWKEFT-UHFFFAOYSA-N | {
"aggregation_method": "individual_record",
"display_measurement_text": "2",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2,
"aggregate_max": 2,
"aggregate_q1": 2,
"agg... | {
"aggregation_method": "individual_record",
"display_measurement_text": "2",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2,
"aggregate_max": 2,
"aggregate_q1": 2,
"agg... | 35 | 34 | 33 | id | train_exact_bucket.v27_safety | identity | {"canonical_assay_context":"bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100/TA1535","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.9,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","exper... | {"canonical_assay_context":"bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100/TA1535","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.8,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","exper... | L1 | gold_v1 | sr_25a248d83eb74cf3862e72a1f67cf8b7 | sr_9896eacde3ee41c382242499a1d42626 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100/TA1535"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>Cc1ccc(N)c(C)c1</SMILES>
- Canonical assay context: bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100
- Canonical measurement scale id: ames_mutagenicity_ordinal... | (B) | train | 23eba09ecf79f08632a564bef69e64a56f33a414236114ae70ec143fc139e4d9 | -1 | null | -1 | null | null | null | ames | mutagenicity_outcomes | limited_balanced_parent_morgan_first.v28_safety | ames:35331c0dec5b6e506af70635b2eb2a9e2f0782e553e15e878ed2a8361dc3bc6c | ames:5e674ac564f9bf52b7a92bb83948c8e6639ed594ae140ead621927bbc86b9175 | ames:35331c0dec5b6e506af70635b2eb2a9e2f0782e553e15e878ed2a8361dc3bc6c | ames:5e674ac564f9bf52b7a92bb83948c8e6639ed594ae140ead621927bbc86b9175 | BQOFWKZOCNGFEC-UHFFFAOYSA-N | CZZZABOKJQXEBO-UHFFFAOYSA-N | CC1=CCC2C(C1)C2(C)C | Cc1ccc(N)c(C)c1 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","L1"] | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","L1"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"canonical_assay_context=bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=... | [
"canonical_assay_context=bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 2 | 0 | 2 | 0.916948 | {
"nontransfer": 0.99999998161063,
"transfer": 1.8389369974017237e-8
} | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","L1"] | L1 | ordinal | {
"calibration_sha256": "6247b4348c45aae52af4abc28a4bc3df331a81fb6e022d4f3e9ceaf6f6844428",
"groups": {
"assay_concept": "L1",
"measurement_kind": "ordinal",
"query_condition_group": "[\"mutagenicity_outcomes\",\"bacterial_reverse_mutation\",\"ordinal_outcome_class\",\"ames_mutagenicity_ordinal.v1\",\"b... | 2 | 2.181149 | 0 | 0.916948 | 0 | 1 | safety_canonical_v27 | 0 | true | 0.151515 | -1 | -1 | -1 | indirect_record | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","L1"] | BQOFWKZOCNGFEC-UHFFFAOYSA-N | CZZZABOKJQXEBO-UHFFFAOYSA-N | C1=CCC2CC2C1 | c1ccccc1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "2",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2,
"aggregate_max": 2,
"aggregate_q1": 2,
"agg... | {
"aggregation_method": "individual_record",
"display_measurement_text": "0",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 0,
"aggregate_max": 0,
"aggregate_q1": 0,
"agg... | 257 | 239 | 201 | id | train_exact_bucket.v27_safety | identity | {"canonical_assay_context":"bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.9,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimental... | {"canonical_assay_context":"bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.85,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimenta... | L1 | gold_v1 | sr_d3bbd55942ae4e81b888798db4bfbfe7 | sr_9367ba02c6434b7ba38bb83d81876896 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>O=[N+]([O-])c1ccc2c3c1ccc1cccc(c13)[C@@H]1O[C@H]21</SMILES>
- Canonical assay context: Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98
- Canonical measurement s... | (A) | train | 1666c8df24eeaf17fc8081ea96f893bac375062d207c30c742420139f1171fd2 | -1 | null | -1 | null | null | null | ames | mutagenicity_outcomes | limited_balanced_parent_morgan_first.v28_safety | ames:0993a100a8353966d6cef154d0ba5bd39cc67c8fff35bdc3304b5e2922dd940e | ames:63f1c250993acd8344e8939d10a085b8913530f044f61223a5d60a0a9afe3b79 | ames:0993a100a8353966d6cef154d0ba5bd39cc67c8fff35bdc3304b5e2922dd940e | ames:63f1c250993acd8344e8939d10a085b8913530f044f61223a5d60a0a9afe3b79 | LMLNXNLVGAZZPV-UHFFFAOYSA-N | HSGLBAJOUBFGPZ-JKSUJKDBSA-N | O=[N+]([O-])c1ccc2ccc3cccc4c3c2c1C1OC41 | O=[N+]([O-])c1ccc2c3c1ccc1cccc(c13)[C@@H]1O[C@H]21 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98","L1"] | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98","L1"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"canonical_assay_context=Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=i... | [
"canonical_assay_context=Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=i... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | near | 2 | 2 | 0 | 0.782226 | {
"nontransfer": 0.01798620996209155,
"transfer": 0.9820137900379085
} | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98","L1"] | L1 | ordinal | {
"calibration_sha256": "6247b4348c45aae52af4abc28a4bc3df331a81fb6e022d4f3e9ceaf6f6844428",
"groups": {
"assay_concept": "L1",
"measurement_kind": "ordinal",
"query_condition_group": "[\"mutagenicity_outcomes\",\"bacterial_reverse_mutation\",\"ordinal_outcome_class\",\"ames_mutagenicity_ordinal.v1\",\"B... | 0 | 0 | 0.982014 | 0.782226 | 0.982014 | 0.017986 | safety_canonical_v27 | 1 | true | 0.736842 | -1 | -1 | -1 | indirect_record | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98","L1"] | LMLNXNLVGAZZPV-UHFFFAOYSA-N | HSGLBAJOUBFGPZ-JKSUJKDBSA-N | c1cc2c3c(c1)ccc1cccc(c13)C1OC21 | c1cc2c3c(c1)ccc1cccc(c13)C1OC21 | {
"aggregation_method": "individual_record",
"display_measurement_text": "2",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2,
"aggregate_max": 2,
"aggregate_q1": 2,
"agg... | {
"aggregation_method": "individual_record",
"display_measurement_text": "2",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2,
"aggregate_max": 2,
"aggregate_q1": 2,
"agg... | 379 | 263 | 166 | id | train_exact_bucket.v27_safety | identity | {"canonical_assay_context":"Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.8,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimental_... | {"canonical_assay_context":"Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.9,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimental_... | L1 | gold_v1 | sr_756309566896496abed43446ef48e875 | sr_377f7d6da86845ba90f1c3a9a44d83e1 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella Typhimurium TA98"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>O=C(/C=C/c1ccc([N+](=O)[O-])cc1)c1ccccc1</SMILES>
- Canonical assay context: Bacterial reverse mutation (Ames) in Salmonella; strains: TA98, TA100
- Canonical measurement scale ... | (B) | train | 69de92755596f363e7ef6c9a3136862b5880ab9679acc302f220958880a6bc5b | -1 | null | -1 | null | null | null | ames | mutagenicity_outcomes | limited_balanced_parent_morgan_first.v28_safety | ames:61b41a9cb71c9cecf03e478b57095fe518b844b324ed1f360db69e548d8210d4 | ames:4b0c8c8ac0af1baeeedddade3f37bb117a3cd808de9ea8a8a2b599d2c13ab52a | ames:61b41a9cb71c9cecf03e478b57095fe518b844b324ed1f360db69e548d8210d4 | ames:4b0c8c8ac0af1baeeedddade3f37bb117a3cd808de9ea8a8a2b599d2c13ab52a | QXYMVUZOGFVPGH-UHFFFAOYSA-N | WDZGGAFMGIOIQS-DHZHZOJOSA-N | Nc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O | O=C(/C=C/c1ccc([N+](=O)[O-])cc1)c1ccccc1 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella; strains: TA98, TA100","L1"] | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella; strains: TA98, TA100","L1"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"canonical_assay_context=Bacterial reverse mutation (Ames) in Salmonella; strains: TA98, TA100",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_cont... | [
"canonical_assay_context=Bacterial reverse mutation (Ames) in Salmonella; strains: TA98, TA100",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_cont... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 2 | 3 | 1 | 0.606092 | {
"nontransfer": 0.9999962702224251,
"transfer": 0.0000037297775749374376
} | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella; strains: TA98, TA100","L1"] | L1 | ordinal | {
"calibration_sha256": "6247b4348c45aae52af4abc28a4bc3df331a81fb6e022d4f3e9ceaf6f6844428",
"groups": {
"assay_concept": "L1",
"measurement_kind": "ordinal",
"query_condition_group": "[\"mutagenicity_outcomes\",\"bacterial_reverse_mutation\",\"ordinal_outcome_class\",\"ames_mutagenicity_ordinal.v1\",\"B... | 1 | 1.649916 | 0.000004 | 0.606092 | 0.000004 | 0.999996 | safety_canonical_v27 | 0 | true | 0.244444 | -1 | -1 | -1 | indirect_record | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella; strains: TA98, TA100","L1"] | QXYMVUZOGFVPGH-UHFFFAOYSA-N | WDZGGAFMGIOIQS-DHZHZOJOSA-N | c1ccccc1 | O=C(C=Cc1ccccc1)c1ccccc1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "2",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2,
"aggregate_max": 2,
"aggregate_q1": 2,
"agg... | {
"aggregation_method": "individual_record",
"display_measurement_text": "3",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 3,
"aggregate_max": 3,
"aggregate_q1": 3,
"agg... | 128 | 98 | 85 | id | train_exact_bucket.v27_safety | identity | {"canonical_assay_context":"Bacterial reverse mutation (Ames) in Salmonella; strains: TA98, TA100","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.75,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experim... | {"canonical_assay_context":"Bacterial reverse mutation (Ames) in Salmonella; strains: TA98, TA100","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.9,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experime... | L1 | gold_v1 | sr_1a50f539b03044f9a2348dcd6c495b18 | sr_99601d6f0ae745379943e58b59a7dde5 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","Bacterial reverse mutation (Ames) in Salmonella; strains: TA98, TA100"] | |
You are comparing two experiments selected from similar assays.
The experimental details may differ.
Experiment A (known measurement)
<SMILES>O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1</SMILES>
- Canonical assay context: bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100
- Canonical measurement scale id: am... | (B) | train | 1c3c078178f1392df43c89345c108d116bf25a67e63b10ed48017734b9a5ee1f | -1 | null | -1 | null | null | null | ames | mutagenicity_outcomes | limited_balanced_parent_morgan_first.v28_safety | ames:250a199dcaa0a659db5745e7db9fe819e256b3f58680c1844883dfbc6ebf120c | ames:51263ee1d6ae27cbf900e2ac63cf099e3c396e75fd74938a729e5b3421f54d75 | ames:250a199dcaa0a659db5745e7db9fe819e256b3f58680c1844883dfbc6ebf120c | ames:51263ee1d6ae27cbf900e2ac63cf099e3c396e75fd74938a729e5b3421f54d75 | KGCNHWXDPDPSBV-UHFFFAOYSA-N | VYZAHLCBVHPDDF-UHFFFAOYSA-N | O=[N+]([O-])c1ccc(CCl)cc1 | O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1 | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","L1"] | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","L1"] | exact_v10_pair_bucket_and_level | exact_v10_pair_bucket_and_level | [
"canonical_assay_context=bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=... | [
"canonical_assay_context=bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100",
"canonical_measurement_scale_id=ames_mutagenicity_ordinal.v1",
"chemical_entity_type=defined_chemical",
"endpoint_name=bacterial_reverse_mutation",
"evidence_basis=current_study_experiment",
"experimental_context=... | same_exact_v10_pair_bucket_and_level | 1 | 1 | null | null | null | null | far | 3 | 2 | 1 | 0.916948 | {
"nontransfer": 0.9989989922425162,
"transfer": 0.001001007757483814
} | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","L1"] | L1 | ordinal | {
"calibration_sha256": "6247b4348c45aae52af4abc28a4bc3df331a81fb6e022d4f3e9ceaf6f6844428",
"groups": {
"assay_concept": "L1",
"measurement_kind": "ordinal",
"query_condition_group": "[\"mutagenicity_outcomes\",\"bacterial_reverse_mutation\",\"ordinal_outcome_class\",\"ames_mutagenicity_ordinal.v1\",\"b... | 1 | 1.090575 | 0.001001 | 0.916948 | 0.001001 | 0.998999 | safety_canonical_v27 | 0 | true | 0.419355 | -1 | -1 | -1 | indirect_record | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","L1"] | KGCNHWXDPDPSBV-UHFFFAOYSA-N | VYZAHLCBVHPDDF-UHFFFAOYSA-N | c1ccccc1 | c1ccccc1 | {
"aggregation_method": "individual_record",
"display_measurement_text": "3",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 3,
"aggregate_max": 3,
"aggregate_q1": 3,
"agg... | {
"aggregation_method": "individual_record",
"display_measurement_text": "2",
"display_unit_text": "ordinal_outcome_class",
"display_transform_id": "canonical_stage3.v10",
"source_record_count": 1,
"deduplicated_source_record_count": 1,
"aggregate_min": 2,
"aggregate_max": 2,
"aggregate_q1": 2,
"agg... | 257 | 239 | 201 | id | train_exact_bucket.v27_safety | identity | {"canonical_assay_context":"bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.9,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimental... | {"canonical_assay_context":"bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100","canonical_measurement_scale_id":"ames_mutagenicity_ordinal.v1","chemical_entity_type":"defined_chemical","confidence":0.9,"endpoint_name":"bacterial_reverse_mutation","evidence_basis":"current_study_experiment","experimental... | L1 | gold_v1 | sr_a30f59c813184e458228abee08807254 | sr_5d68eabf0b664ff384ec195c86a6141f | ["mutagenicity_outcomes","bacterial_reverse_mutation","ordinal_outcome_class","ames_mutagenicity_ordinal.v1","bacterial reverse mutation (Ames) in Salmonella Typhimurium TA100"] |
End of preview. Expand in Data Studio
Ames record-level V27 L1
This level-specific release uses current V10 physical evidence, the active Gold-owned level mapping, and Gold-v1 parent-disjoint evaluation. Undefined variance ratios are allowed; defined ratios above 0.65 are excluded. Prompts display canonical Stage-3 measurement and unit pairs.
Rows: {'train': 460, 'validation_ranking': 13059, 'test_ranking': 11592}
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