Brief Information of the Compound and Protein
Compound Name
1-(3-Chloro-phenyl)-3-(8-ethyl-2-furan-2-yl-8H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)-urea
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PubChem ID
CID: 9910158
SID: 14880410
Canonical SMILES
CCn1cc2c(n1)nc(NC(=O)Nc1cccc(Cl)c1)n1nc(nc21)-c1ccco1
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Compound Formula C19H15ClN8O2
Compound Structure
Protein Name
Adenosine receptor A3
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
>
Small molecule receptor (family A GPCR)
>
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)  5
1
IC50 = 14.8 nM
   TI
   LI
   LO
   TS
2
IC50 = 15.1 nM
   TI
   LI
   LO
   TS
3
Ki = 1.6 nM
   TI
   LI
   LO
   TS
4
Ki = 2.1 nM
   TI
   LI
   LO
   TS
5
Ki = 912.01 nM
   TI
   LI
   LO
   TS
CL000006 HEK293 Homo sapiens (Human)  2
1
Ki = 1.6 nM
   TI
   LI
   LO
   TS
2
Ki = 2.09 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Ki = 1.6 nM