Brief Information of the Compound and Protein
Compound Name
(2R,3R,4S,5R)-2-[6-[(3-bromophenyl)methylamino]-2-chloropurin-9-yl]-5-(2-ethyltetrazol-5-yl)oxolane-3,4-diol
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PubChem ID
CID: 137636099
Canonical SMILES
CCn1nnc(n1)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3cccc(Br)c3)nc(Cl)nc12
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Compound Formula C19H19BrClN9O3
Compound Structure
Protein Name
Adenosine receptor A3
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
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
CL000011 CHO Cricetulus griseus (Chinese hamster)  2
1
EC50 = 9.64 nM
   TI
   LI
   LO
   TS
2
Ki = 0.345 nM
   TI
   LI
   LO
   TS