Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(1S,2R,5S,10R,11S,15S)-2,15-dimethyl-14-(pyridin-3-yl)tetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-7,13-dien-5-ol
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 PubChem ID
CID: 132971
SID: 14925329
Canonical SMILES
C[C@]12CC[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@]34C)[C@@H]1CC=C2c1cccnc1
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Compound Formula C24H31NO
Compound Structure
Protein Name
 Protein Info 
Steroid 17-alpha-hydroxylase/17,20 lyase
Protein Classification
Enzyme
>
Cytochrome P450
>
Cytochrome P450 family 17
>
Cytochrome P450 family 17A
>
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
CL000068 A-549
 Cell Line Info 
Homo sapiens (Human)  1
1
IC50 = 35.8 nM
   TI
   LI
   LO
   TS
CL000141 LNCaP
 Cell Line Info 
Homo sapiens (Human)  1
1
IC50 = 800 nM
   TI
   LI
   LO
   TS
CL000263 NCI-H295R
 Cell Line Info 
Homo sapiens (Human)  1
1
IC50 <= 15 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 2 nM
2 IC50 = 2.9 nM
3 IC50 = 4 nM
4 IC50 = 5 nM
5 IC50 = 48 nM
6 IC50 ~ 1 nM