Brief Information of the Compound and Protein
Compound Name
1-(3-fluoropropyl)-N-[4-[[2-[4-fluoro-2-(2,2,2-trifluoroethyl)phenyl]-6H-thieno[2,3-e]indazol-3-yl]oxy]phenyl]azetidin-3-amine
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PubChem ID
CID: 168274278
Canonical SMILES
FCCCN1CC(C1)Nc1ccc(Oc2c(sc3c4cn[nH]c4ccc23)-c2ccc(F)cc2CC(F)(F)F)cc1
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Compound Formula C29H25F5N4OS
Compound Structure
Protein Name
Estrogen receptor
Protein Classification
Transcription factor
>
Nuclear receptor
>
Nuclear hormone receptor subfamily 3
>
Nuclear hormone receptor subfamily 3 group A
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Nuclear hormone receptor subfamily 3 group A member 1
Uniprot ID
P03372
Gene Name
ESR1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL001042 HEK293/Gal4 Homo sapiens (Human)  1
1
IC50 = 1.3 nM
   TI
   LI
   LO
   TS
CL000083 MCF-7 Homo sapiens (Human)  1
1
EC50 = 2.2 nM
   TI
   LI
   LO
   TS