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Assay Detail

CHEMBL1006441

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

Binding
Inhibition of human CYP17 expressed in Escherichia coli coexpressed with cytochrome P450 reductase
39
Total Activities
39
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
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

Synthesis, biological evaluation, and molecular modeling studies of methylene imidazole substituted biaryls as inhibitors of human 17alpha-hydroxylase-17,20-lyase (CYP17)--part II: Core rigidification and influence of substituents at the methylene bridge.
Hu Q, Negri M, Jahn-Hoffmann K, Zhuang Y, Olgen S, Bartels M, Müller-Vieira U, Lauterbach T, Hartmann RW.
Bioorg Med Chem (2008) 16 : 7715 -7727
PubMed 18674917 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 39 6.19 7.14

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL254328 ABIRATERONE 3.0 1 7.14
CHEMBL505550 1 7.00
CHEMBL501198 1 6.95
CHEMBL454217 1 6.93
CHEMBL501460 1 6.78
CHEMBL499882 1 6.55
CHEMBL498523 1 6.52
CHEMBL496468 1 6.51
CHEMBL527112 1 6.46
CHEMBL500680 1 6.43
CHEMBL502542 1 6.41
CHEMBL497500 1 6.35
CHEMBL498522 1 6.34
CHEMBL449343 1 6.24
CHEMBL500139 1 6.12
CHEMBL526293 1 6.11
CHEMBL277535 BIFONAZOLE 3.0 1 6.10
CHEMBL497499 1 6.04
CHEMBL526104 1 5.98
CHEMBL445171 1 5.96
CHEMBL501446 1 5.89
CHEMBL443865 1 5.85
CHEMBL500679 1 5.77
CHEMBL496257 1 5.70
CHEMBL497851 1 5.68
CHEMBL500425 1 5.66
CHEMBL498534 1 5.64
CHEMBL157101 KETOCONAZOLE 4.0 1 5.56
CHEMBL498641 1 5.51
CHEMBL502802 1 5.42

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL254328 ABIRATERONE IC50 = 72.0 nM 7.14
CHEMBL505550 IC50 = 99.0 nM 7.00
CHEMBL501198 IC50 = 112.0 nM 6.95
CHEMBL454217 IC50 = 118.0 nM 6.93
CHEMBL501460 IC50 = 168.0 nM 6.78
CHEMBL499882 IC50 = 282.0 nM 6.55
CHEMBL498523 IC50 = 300.0 nM 6.52
CHEMBL496468 IC50 = 310.0 nM 6.51
CHEMBL527112 IC50 = 345.0 nM 6.46
CHEMBL500680 IC50 = 375.0 nM 6.43
CHEMBL502542 IC50 = 388.0 nM 6.41
CHEMBL497500 IC50 = 450.0 nM 6.35
CHEMBL498522 IC50 = 460.0 nM 6.34
CHEMBL449343 IC50 = 580.0 nM 6.24
CHEMBL500139 IC50 = 756.0 nM 6.12
CHEMBL526293 IC50 = 780.0 nM 6.11
CHEMBL277535 BIFONAZOLE IC50 = 790.0 nM 6.10
CHEMBL497499 IC50 = 910.0 nM 6.04
CHEMBL526104 IC50 = 1050.0 nM 5.98
CHEMBL445171 IC50 = 1100.0 nM 5.96
CHEMBL501446 IC50 = 1300.0 nM 5.89
CHEMBL443865 IC50 = 1400.0 nM 5.85
CHEMBL500679 IC50 = 1700.0 nM 5.77
CHEMBL496257 IC50 = 2000.0 nM 5.70
CHEMBL497851 IC50 = 2100.0 nM 5.68
CHEMBL500425 IC50 = 2200.0 nM 5.66
CHEMBL498534 IC50 = 2300.0 nM 5.64
CHEMBL157101 KETOCONAZOLE IC50 = 2780.0 nM 5.56
CHEMBL498641 IC50 = 3100.0 nM 5.51
CHEMBL502802 IC50 = 3800.0 nM 5.42
CHEMBL524989 IC50 > 5000.0 nM -
CHEMBL504098 IC50 > 5000.0 nM -
CHEMBL526722 IC50 > 5000.0 nM -
CHEMBL442568 IC50 > 5000.0 nM -
CHEMBL498642 IC50 > 5000.0 nM -
CHEMBL524681 IC50 > 5000.0 nM -
CHEMBL500140 IC50 > 5000.0 nM -
CHEMBL503503 IC50 > 5000.0 nM -
CHEMBL496258 IC50 > 5000.0 nM -