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Assay Detail

CHEMBL828029

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

Binding
In vitro inhibitory concentration against Cytochrome P450 17 expressed in Escherichia coli
9
Total Activities
9
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Expert

Target

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

Publication

Novel C-17-heteroaryl steroidal CYP17 inhibitors/antiandrogens: synthesis, in vitro biological activity, pharmacokinetics, and antitumor activity in the LAPC4 human prostate cancer xenograft model.
Handratta VD, Vasaitis TS, Njar VC, Gediya LK, Kataria R, Chopra P, Newman D, Farquhar R, Guo Z, Qiu Y, Brodie AM.
J Med Chem (2005) 48 : 2972 -2984
PubMed 15828836 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 9 6.09 7.30

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL74661 1 7.30
CHEMBL75474 1 6.52
CHEMBL77062 1 6.30
CHEMBL254328 ABIRATERONE 3.0 1 6.10
CHEMBL77789 1 6.04
CHEMBL157101 KETOCONAZOLE 4.0 1 5.96
CHEMBL78222 1 5.90
CHEMBL74606 1 5.42
CHEMBL363364 1 5.24

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL74661 IC50 = 50.0 nM 7.30
CHEMBL75474 IC50 = 300.0 nM 6.52
CHEMBL77062 IC50 = 500.0 nM 6.30
CHEMBL254328 ABIRATERONE IC50 = 800.0 nM 6.10
CHEMBL77789 IC50 = 915.0 nM 6.04
CHEMBL157101 KETOCONAZOLE IC50 = 1100.0 nM 5.96
CHEMBL78222 IC50 = 1250.0 nM 5.90
CHEMBL74606 IC50 = 3810.0 nM 5.42
CHEMBL363364 IC50 = 5817.4 nM 5.24