Brief Information of the Compound and Protein
Compound Name
 Compound Info 
4-(mesityloxy)-2-(trifluoromethyl)benzonitrile
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 PubChem ID
CID: 11587567
SID: 16690060
Canonical SMILES
Cc1cc(C)c(Oc2ccc(C#N)c(c2)C(F)(F)F)c(C)c1
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Compound Formula C17H14F3NO
Compound Structure
Protein Name
 Protein Info 
Androgen receptor
Protein Classification
Transcription factor
>
Nuclear receptor
>
Nuclear hormone receptor subfamily 3
>
Nuclear hormone receptor subfamily 3 group C
>
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
CL000111 MDA-MB-231
 Cell Line Info 
Homo sapiens (Human)  1
1
IC50 = 812 nM
   TI
   LI
   LO
   TS
CL000013 Sf9
 Cell Line Info 
Spodoptera frugiperda (Fall armyworm)  1
1
IC50 = 198 nM
   TI
   LI
   LO
   TS