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Assay Detail

CHEMBL1909137

Review assay metadata, readout intent, target linkage, and publication context from the same page.

Binding
DRUGMATRIX: CYP450, 2E1 enzyme inhibition (substrate: 3-Cyano-7-ethoxycoumarin)
ChEMBL ↗
1742
Total Activities
871
Compounds Tested
2
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Cell Type BTI-TN-5B1-4
Confidence 8 — Homologous single protein target
Curated By Autocuration

Target

Cytochrome P450 2E1 (CHEMBL5281) ↗
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

DrugMatrix in vitro pharmacology data
Scott S. Auerbach, DrugMatrix¨ and ToxFX¨ Coordinator National Toxicology Program

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 871 4.96 4.96
Ki 871 - -

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL44814 CARBON TETRACHLORIDE -1.0 2 4.96
CHEMBL894 BUPROPION 4.0 2 -
CHEMBL1487 ATORVASTATIN 4.0 2 -
CHEMBL1256017 ARCAINE SULFATE — 2 -
CHEMBL508102 CARBIMAZOLE 3.0 2 -
CHEMBL49 BUSPIRONE 4.0 2 -
CHEMBL253376 BROMHEXINE 3.0 2 -
CHEMBL402794 BIS(2-ETHYLHEXYL)PHTHALATE — 2 -
CHEMBL135 ESTRADIOL 4.0 2 -
CHEMBL113 CAFFEINE 4.0 2 -
CHEMBL31184 BENZO[DEF]CHRYSENE 0.5 2 -
CHEMBL1201346 BALSALAZIDE 4.0 2 -
CHEMBL1598608 AZASETRON 2.0 2 -
CHEMBL24 ATENOLOL 4.0 2 -
CHEMBL277474 ANTIPYRINE 3.0 2 -
CHEMBL108 CARBAMAZEPINE 4.0 2 -
CHEMBL1077 BROMFENAC 4.0 2 -
CHEMBL264374 BEZAFIBRATE 3.0 2 -
CHEMBL415690 BETADEX 3.0 2 -
CHEMBL319244 CAFFEIC ACID PHENETHYL ESTER — 2 -
CHEMBL221753 BENZETHONIUM CHLORIDE 2.0 2 -
CHEMBL701 BACLOFEN 4.0 2 -
CHEMBL1095699 AZASERINE 2.0 2 -
CHEMBL3084803 ASTROMICIN 2.0 2 -
CHEMBL211501 ANTIMYCIN A — 2 -
CHEMBL1458880 CADMIUM DICHLORIDE — 2 -
CHEMBL1200396 BUPIVACAINE HYDROCHLORIDE 4.0 2 -
CHEMBL844 BRIMONIDINE 4.0 2 -
CHEMBL1231530 BETAMIPRON 2.0 2 -
CHEMBL12089 BERBERINE CHLORIDE 1.0 2 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL44814 CARBON TETRACHLORIDE IC50 = 11000.0 nM 4.96
CHEMBL19215 METERGOLINE IC50 - — -
CHEMBL2106399 KITASAMYCIN IC50 - — -
CHEMBL2106399 KITASAMYCIN Ki - — -
CHEMBL503 LOVASTATIN IC50 - — -
CHEMBL1201193 LEVOBUPIVACAINE IC50 - — -
CHEMBL80 NALOXONE Ki - — -
CHEMBL80 NALOXONE IC50 - — -
CHEMBL878 METOLAZONE Ki - — -
CHEMBL878 METOLAZONE IC50 - — -
CHEMBL313493 METHANESULFONIC ACID METHYL ESTER Ki - — -
CHEMBL313493 METHANESULFONIC ACID METHYL ESTER IC50 - — -
CHEMBL19215 METERGOLINE Ki - — -
CHEMBL64391 ITRACONAZOLE Ki - — -
CHEMBL45 MELATONIN Ki - — -
CHEMBL45 MELATONIN IC50 - — -
CHEMBL1237 LISINOPRIL ANHYDROUS Ki - — -
CHEMBL1237 LISINOPRIL ANHYDROUS IC50 - — -
CHEMBL1201193 LEVOBUPIVACAINE Ki - — -
CHEMBL91 MICONAZOLE IC50 - — -
CHEMBL1373 MODAFINIL Ki - — -
CHEMBL1373 MODAFINIL IC50 - — -
CHEMBL91 MICONAZOLE Ki - — -
CHEMBL164290 N-NITROSODIETHYLAMINE IC50 - — -
CHEMBL1909067 — Ki - — -
CHEMBL1909067 — IC50 - — -
CHEMBL1201151 MESTRANOL IC50 - — -
CHEMBL503 LOVASTATIN Ki - — -
CHEMBL19019 NALTREXONE IC50 - — -
CHEMBL19019 NALTREXONE Ki - — -
CHEMBL741 LAMOTRIGINE IC50 - — -
CHEMBL741 LAMOTRIGINE Ki - — -
CHEMBL1201237 LEVOBUNOLOL IC50 - — -
CHEMBL1201237 LEVOBUNOLOL Ki - — -
CHEMBL1909064 LIPOPOLYSACCHARIDE E. COLI O55:B5 IC50 - — -
CHEMBL1909064 LIPOPOLYSACCHARIDE E. COLI O55:B5 Ki - — -
CHEMBL1201139 MEGESTROL ACETATE IC50 - — -
CHEMBL1201139 MEGESTROL ACETATE Ki - — -
CHEMBL64391 ITRACONAZOLE IC50 - — -
CHEMBL1201151 MESTRANOL Ki - — -
CHEMBL1354199 METHSCOPOLAMINE BROMIDE IC50 - — -
CHEMBL1354199 METHSCOPOLAMINE BROMIDE Ki - — -
CHEMBL86 METOCLOPRAMIDE IC50 - — -
CHEMBL86 METOCLOPRAMIDE Ki - — -
CHEMBL6437 MIANSERIN IC50 - — -
CHEMBL6437 MIANSERIN Ki - — -
CHEMBL1618305 NALOXONAZINE IC50 - — -
CHEMBL1618305 NALOXONAZINE Ki - — -
CHEMBL92401 IPRONIAZID IC50 - — -
CHEMBL92401 IPRONIAZID Ki - — -