Brief Information of the Compound and Protein
Compound Name
 Compound Info 
ethyl 2-[[[(2R,3S,4R,5R)-5-[2-chloro-6-(cyclopentylamino)purin-9-yl]-3,4-dihydroxyoxolan-2-yl]methoxy-[(2-ethoxy-2-oxoethyl)amino]phosphoryl]amino]acetate
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 PubChem ID
CID: 60194917
SID: 144202428
Canonical SMILES
CCOC(=O)CNP(=O)(NCC(=O)OCC)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC3CCCC3)nc(Cl)nc12
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Compound Formula C23H35ClN7O9P
Compound Structure
Protein Name
 Protein Info 
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
CL000314 HEK293T/17
 Cell Line Info 
Homo sapiens (Human)  1
1
EC50 = 530 nM
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   LI
   LO
   TS