Brief Information of the Compound and Protein
Compound Name
1-[4-[2-[4-[1-[3-(trifluoromethyl)-7,8-dihydro-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidin-4-yl]phenoxy]ethyl]piperazin-1-yl]ethanone
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PubChem ID
CID: 46893585
SID: 99346024
Canonical SMILES
CC(=O)N1CCN(CCOc2ccc(cc2)C2CCN(CC2)C2=Nn3c(CC2)nnc3C(F)(F)F)CC1
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Compound Formula C25H32F3N7O2
Compound Structure
Protein Name
Androgen receptor
Protein Classification
Transcription factor
>
Nuclear receptor
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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
CL000141 LNCaP Homo sapiens (Human)  2
1
IC50 = 1778.28 nM
   TI
   LI
   LO
   TS
2
Ki = 2200 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 > 1778.28 nM
2 Ki = 2200 nM
3 Ki = 5000 nM