Brief Information of the Compound and Protein
Compound Name
5-[5-[4-(1-methylpiperidin-4-yl)oxyphenyl]-8-oxo-6-sulfanylidene-5,7-diazaspiro[3.4]octan-7-yl]-3-(trifluoromethyl)pyridine-2-carbonitrile
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PubChem ID
CID: 86683482
Canonical SMILES
CN1CCC(CC1)Oc1ccc(cc1)N1C(=S)N(C(=O)C11CCC1)c1cnc(C#N)c(c1)C(F)(F)F
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Compound Formula C25H24F3N5O2S
Compound Structure
Protein Name
Androgen receptor
Protein Classification
Transcription factor
>
Nuclear receptor
>
Nuclear hormone receptor subfamily 3
>
Nuclear hormone receptor subfamily 3 group C
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Nuclear hormone receptor subfamily 3 group C member 4
Uniprot ID
P10275
Gene Name
AR
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000063 Hep-G2 Homo sapiens (Human)  1
1
IC50 = 127 nM
   TI
   LI
   LO
   TS
CL000141 LNCaP Homo sapiens (Human)  4
1
IC50 = 19 nM
   TI
   LI
   LO
   TS
2
IC50 = 98 nM
   TI
   LI
   LO
   TS
3
IC50 = 191 nM
   TI
   LI
   LO
   TS
4
Ki = 8.4 nM
   TI
   LI
   LO
   TS