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Assay Detail

CHEMBL1687152

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

ADMET
Inhibition of human CYP3A4
21
Total Activities
19
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 3A4 (CHEMBL340)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

17,20-lyase inhibitors. Part 4: design, synthesis and structure-activity relationships of naphthylmethylimidazole derivatives as novel 17,20-lyase inhibitors.
Kaku T, Matsunaga N, Ojida A, Tanaka T, Hara T, Yamaoka M, Kusaka M, Tasaka A.
Bioorg Med Chem (2011) 19 : 1751 -1770
PubMed 21316976 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 21 5.39 5.85

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL1682888 1 5.85
CHEMBL1682891 1 5.85
CHEMBL1682895 1 5.47
CHEMBL1682893 1 5.44
CHEMBL1682899 1 5.44
CHEMBL1682892 1 5.43
CHEMBL1682903 1 5.27
CHEMBL1682894 1 5.24
CHEMBL1682900 3 5.17
CHEMBL1682896 1 5.03
CHEMBL1682887 1 -
CHEMBL1682889 1 -
CHEMBL1682890 1 -
CHEMBL1682897 1 -
CHEMBL1682898 1 -
CHEMBL1682901 1 -
CHEMBL1682902 1 -
CHEMBL1682904 1 -
CHEMBL1682905 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL1682888 IC50 = 1400.0 nM 5.85
CHEMBL1682891 IC50 = 1400.0 nM 5.85
CHEMBL1682895 IC50 = 3400.0 nM 5.47
CHEMBL1682893 IC50 = 3600.0 nM 5.44
CHEMBL1682899 IC50 = 3600.0 nM 5.44
CHEMBL1682892 IC50 = 3700.0 nM 5.43
CHEMBL1682903 IC50 = 5400.0 nM 5.27
CHEMBL1682894 IC50 = 5700.0 nM 5.24
CHEMBL1682900 IC50 = 6700.0 nM 5.17
CHEMBL1682900 IC50 = 7400.0 nM 5.13
CHEMBL1682896 IC50 = 9300.0 nM 5.03
CHEMBL1682887 IC50 < 1000.0 nM -
CHEMBL1682889 IC50 < 1000.0 nM -
CHEMBL1682890 IC50 < 1000.0 nM -
CHEMBL1682897 IC50 > 10000.0 nM -
CHEMBL1682898 IC50 > 10000.0 nM -
CHEMBL1682901 IC50 > 10000.0 nM -
CHEMBL1682902 IC50 > 10000.0 nM -
CHEMBL1682900 IC50 > 10000.0 nM -
CHEMBL1682904 IC50 > 10000.0 nM -
CHEMBL1682905 IC50 > 10000.0 nM -