Brief Information of the Compound and Protein
Compound Name
 Compound Info 
2-amino-8-fluoro-N-[[3-[4-[4-(2-methoxyethoxy)phenyl]piperazine-1-carbonyl]quinolin-8-yl]methyl]quinazoline-4-carboxamide
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 PubChem ID
CID: 127042900
Canonical SMILES
COCCOc1ccc(cc1)N1CCN(CC1)C(=O)c1cnc2c(CNC(=O)c3nc(N)nc4c(F)cccc34)cccc2c1
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Compound Formula C33H32FN7O4
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
CL000011 CHO
 Cell Line Info 
Cricetulus griseus (Chinese hamster)  1
1
Ki = 120 nM
   TI
   LI
   LO
   TS