Brief Information of the Compound and Protein
Compound Name
2-amino-6-(2-hydroxyethylsulfanyl)-4-pyridin-3-ylpyridine-3,5-dicarbonitrile
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PubChem ID
CID: 28622387
Canonical SMILES
Nc1nc(SCCO)c(C#N)c(-c2cccnc2)c1C#N
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Compound Formula C14H11N5OS
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
CL000011 CHO Cricetulus griseus (Chinese hamster)  2
1
EC50 = 94 nM
   TI
   LI
   LO
   TS
2
Ki = 35 nM
   TI
   LI
   LO
   TS