Brief Information of the Compound and Protein
Compound Name
 Compound Info 
8-cyclopentyl-1-propyl-2-[3-(trifluoromethyl)phenoxy]-7H-purin-6-one
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 PubChem ID
CID: 70655981
Canonical SMILES
CCCn1c(Oc2cccc(c2)C(F)(F)F)nc2nc([nH]c2c1=O)C1CCCC1
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Compound Formula C20H21F3N4O2
Compound Structure
Protein Name
 Protein Info 
Adenosine receptor A1
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
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Small molecule receptor (family A GPCR)
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Nucleotide-like receptor (family A GPCR)
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Adenosine receptor
Uniprot ID
P30542
Gene Name
ADORA1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293
 Cell Line Info 
Homo sapiens (Human)  2
1
Ki = 5.9 nM
   TI
   LI
   LO
   TS
2
Ki = 19 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Ki = 19 nM