Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(2R,3R,4S,5S)-2-(6-(5-chloro-2-methoxybenzylamino)-9H-purin-9-yl)-4-(aminomethyl)-5-(hydroxymethyl)-tetrahydrofuran-3-ol
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 PubChem ID
CID: 44410590
Canonical SMILES
COc1ccc(Cl)cc1CNc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](CN)[C@H]1O
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Compound Formula C19H23ClN6O4
Compound Structure
Protein Name
 Protein Info 
Adenosine receptor A3
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
>
Small molecule receptor (family A GPCR)
>
Nucleotide-like receptor (family A GPCR)
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Adenosine receptor
Uniprot ID
P0DMS8
Gene Name
ADORA3
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000053 COS-7
 Cell Line Info 
Chlorocebus aethiops (Green monkey)  5
1
Ki = 709 nM
   TI
   LI
   LO
   TS
2
Ki = 2000 nM
   TI
   LI
   LO
   TS
3
Ki = 9800 nM
   TI
   LI
   LO
   TS
4
Ki > 10000 nM
   TI
   LI
   LO
   TS
5
Ki = 13800 nM
   TI
   LI
   LO
   TS