Brief Information of the Compound and Protein
Compound Name
8-cyclopentyl-1-propyl-2-[3-(trifluoromethyl)anilino]-7H-purin-6-one
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PubChem ID
CID: 70660767
Canonical SMILES
CCCn1c(Nc2cccc(c2)C(F)(F)F)nc2nc([nH]c2c1=O)C1CCCC1
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Compound Formula C20H22F3N5O
Compound Structure
Protein Name
Adenosine receptor A1
Protein Classification
Membrane receptor
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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 Homo sapiens (Human)  1
1
Ki = 370 nM
   TI
   LI
   LO
   TS