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Assay Detail

CHEMBL3868072

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

Binding
Inhibition of recombinant CYP17 (unknown origin) overexpressed in human AD293 cells using [21-3H]17alpha-hydroxyl-pregenolone as substrate preincubated for 60 mins followed by substrate addition measured after 4 hrs by Topcount method
15
Total Activities
14
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type AD293
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Steroid 17-alpha-hydroxylase/17,20 lyase (CHEMBL3522)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Design, synthesis, and evaluation of (2S,4R)-Ketoconazole sulfonamide analogs as potential treatments for Metabolic Syndrome.
Blass BE, Iyer P, Abou-Gharbia M, Childers WE, Gordon JC, Ramanjulu M, Morton G, Arumugam P, Boruwa J, Ellingboe J, Mitra S, Nimmareddy RR, Paliwal S, Rajasekhar J, Shivakumar S, Srivastava P, Tangirala RS, Venkataramanaiah K, Yanamandra M.
Bioorg Med Chem Lett (2016) 26 : 5825 -5829
PubMed 27789139 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 15 7.76 9.14

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3913908 1 9.14
CHEMBL3922888 1 8.43
CHEMBL3980889 1 8.15
CHEMBL3968178 1 8.10
CHEMBL3952032 1 8.05
CHEMBL3960724 1 8.05
CHEMBL3931836 1 7.96
CHEMBL3894912 1 7.92
CHEMBL3983734 1 7.82
CHEMBL3891718 1 7.82
CHEMBL3964421 1 7.72
CHEMBL157101 KETOCONAZOLE 4.0 2 7.32
CHEMBL3938615 1 7.17
CHEMBL75 1 5.75

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3913908 IC50 = 0.73 nM 9.14
CHEMBL3922888 IC50 = 3.7 nM 8.43
CHEMBL3980889 IC50 = 7.0 nM 8.15
CHEMBL3968178 IC50 = 8.0 nM 8.10
CHEMBL3952032 IC50 = 9.0 nM 8.05
CHEMBL3960724 IC50 = 9.0 nM 8.05
CHEMBL3931836 IC50 = 11.0 nM 7.96
CHEMBL3894912 IC50 = 12.0 nM 7.92
CHEMBL3983734 IC50 = 15.0 nM 7.82
CHEMBL3891718 IC50 = 15.0 nM 7.82
CHEMBL3964421 IC50 = 19.0 nM 7.72
CHEMBL157101 KETOCONAZOLE IC50 = 48.0 nM 7.32
CHEMBL3938615 IC50 = 67.0 nM 7.17
CHEMBL157101 KETOCONAZOLE IC50 = 93.0 nM 7.03
CHEMBL75 IC50 = 1800.0 nM 5.75