Brief Information of the Compound and Protein
Compound Name
 Compound Info 
1-[8-Isopropyl-6-(4-trifluoromethyl-phenylamino)-9H-purin-2-yl]-piperidin-4-ol
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 PubChem ID
CID: 22901328
Canonical SMILES
CC(C)c1nc2nc(nc(Nc3ccc(cc3)C(F)(F)F)c2[nH]1)N1CCC(O)CC1
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Compound Formula C20H23F3N6O
Compound Structure
Protein Name
 Protein Info 
Substance-K receptor
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
>
Peptide receptor (family A GPCR)
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Short peptide receptor (family A GPCR)
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Neurokinin receptor
Uniprot ID
P21452
Gene Name
TACR2
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000012 Sf21
 Cell Line Info 
Spodoptera frugiperda (Fall armyworm)  1
1
Ki = 1770 nM
   TI
   LI
   LO
   TS