Brief Information of the Compound and Protein
Compound Name
(5aS,5bS,7aS,10aS,10bR,12aS)-5a,7a-dimethyl-8-(4-methylpyridin-3-yl)-3,4,5,5a,5b,6,7,7a,10,10a,10b,11,12,12a-tetradecahydrocyclopenta[5,6]naphtho[1,2-d]azepin-2(1H)-one
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PubChem ID
CID: 89882800
Canonical SMILES
Cc1ccncc1C1=CC[C@H]2[C@@H]3CC[C@H]4CC(=O)NCC[C@]4(C)[C@H]3CC[C@]12C
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Compound Formula C25H34N2O
Compound Structure
Protein Name
Steroid 17-alpha-hydroxylase/17,20 lyase
Protein Classification
Enzyme
>
Cytochrome P450
>
Cytochrome P450 family 17
>
Cytochrome P450 family 17A
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Cytochrome P450 17A1
Uniprot ID
P05093
Gene Name
CYP17A1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000263 NCI-H295R Homo sapiens (Human)  1
1
IC50 <= 15 nM
   TI
   LI
   LO
   TS