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Assay Detail

CHEMBL971609

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

ADMET
Inhibition of human recombinant CYP3A4 in human liver microsomes using BFC as a substrate
10
Total Activities
10
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Cytochrome P450 3A4 (CHEMBL340)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery and evaluation of 4-(2-(4-chloro-1H-pyrazol-1-yl)ethylamino)-3-(6-(1-(3-fluoropropyl)piperidin-4-yl)-4-methyl-1H-benzo[d]imidazol-2-yl)pyridin-2(1H)-one (BMS-695735), an orally efficacious inhibitor of insulin-like growth factor-1 receptor kinase with broad spectrum in vivo antitumor activity.
Velaparthi U, Wittman M, Liu P, Carboni JM, Lee FY, Attar R, Balimane P, Clarke W, Sinz MW, Hurlburt W, Patel K, Discenza L, Kim S, Gottardis M, Greer A, Li A, Saulnier M, Yang Z, Zimmermann K, Trainor G, Vyas D.
J Med Chem (2008) 51 : 5897 -5900
PubMed 18763755 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 10 5.01 7.30

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL401930 1 7.30
CHEMBL512126 1 5.11
CHEMBL469292 1 5.00
CHEMBL468671 1 4.96
CHEMBL461198 1 4.85
CHEMBL460997 1 4.71
CHEMBL460996 1 4.64
CHEMBL459729 1 4.58
CHEMBL468672 1 4.55
CHEMBL461422 1 4.40

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL401930 IC50 = 50.0 nM 7.30
CHEMBL512126 IC50 = 7700.0 nM 5.11
CHEMBL469292 IC50 = 10000.0 nM 5.00
CHEMBL468671 IC50 = 11000.0 nM 4.96
CHEMBL461198 IC50 = 14000.0 nM 4.85
CHEMBL460997 IC50 = 19500.0 nM 4.71
CHEMBL460996 IC50 = 23000.0 nM 4.64
CHEMBL459729 IC50 = 26000.0 nM 4.58
CHEMBL468672 IC50 = 28000.0 nM 4.55
CHEMBL461422 IC50 = 40000.0 nM 4.40