Brief Information of the Compound and Protein
Compound Name
8-(3,4-dimethoxystyryl)-1,3-diethyl-7-methyl-1H-purine-2,6(3H,7H)-dione
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PubChem ID
CID: 5311037
SID: 12014869
Canonical SMILES
CCn1c2nc(\C=C\c3ccc(OC)c(OC)c3)n(C)c2c(=O)n(CC)c1=O
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Compound Formula C20H24N4O4
Compound Structure
Protein Name
Adenosine receptor A1
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
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)  5
1
Ki = 841 nM
   TI
   LI
   LO
   TS
2
Ki = 2070 nM
   TI
   LI
   LO
   TS
3
Ki = 2830 nM
   TI
   LI
   LO
   TS
4
Ki = 3000 nM
   TI
   LI
   LO
   TS
5
Ki > 1000 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Ki = 841 nM
2 Ki = 2830 nM
3 Ki = 3000 nM