Brief Information of the Compound and Protein
Compound Name
2-amino-8-[2-[(2S)-4-(2-fluoro-4-methoxyphenyl)-2-methylpiperazin-1-yl]ethyl]-4-(5-methylfuran-2-yl)pteridin-7-one
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PubChem ID
CID: 163215434
Canonical SMILES
COc1ccc(N2CCN(CCn3c4nc(N)nc(-c5ccc(C)o5)c4ncc3=O)[C@@H](C)C2)c(F)c1
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Compound Formula C25H28FN7O3
Compound Structure
Protein Name
Adenosine receptor A2a
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
P29274
Gene Name
ADORA2A
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)  3
1
IC50 = 6.6 nM
   TI
   LI
   LO
   TS
2
IC50 = 8.3 nM
   TI
   LI
   LO
   TS
3
IC50 = 179.6 nM
   TI
   LI
   LO
   TS