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Assay Detail

CHEMBL3532208

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ADMET
Competitive inhibition of CYP2A13 (unknown origin)
4
Total Activities
4
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type ADMET
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Cytochrome P450 2A13 (CHEMBL3542436)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Evaluation of inhibition selectivity for human cytochrome P450 2A enzymes.
Stephens ES, Walsh AA, Scott EE.
Drug Metab Dispos (2012) 40 : 1797 -1802
PubMed 22696418 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 4 5.00 5.85

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL550 PILOCARPINE 4.0 1 5.85
CHEMBL3989843 TRANYLCYPROMINE 4.0 1 5.19
CHEMBL6640 TRYPTAMINE 1 4.80
CHEMBL3 NICOTINE 4.0 1 4.14

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL550 PILOCARPINE Ki = 1400.0 nM 5.85
CHEMBL3989843 TRANYLCYPROMINE Ki = 6500.0 nM 5.19
CHEMBL6640 TRYPTAMINE Ki = 16000.0 nM 4.80
CHEMBL3 NICOTINE Ki = 72000.0 nM 4.14