Brief Information of the Compound and Protein
Compound Name
 Compound Info 
US8835470, 137
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 PubChem ID
CID: 71258048
Canonical SMILES
O[C@@H](C(=O)NCc1ccccn1)c1ccc(cc1)-c1noc(n1)-c1cnn(c1C(F)(F)F)-c1ccccc1
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Compound Formula C26H19F3N6O3
Compound Structure
Protein Name
 Protein Info 
Sphingosine 1-phosphate receptor 1
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
>
Small molecule receptor (family A GPCR)
>
Lipid-like ligand receptor (family A GPCR)
>
EDG receptor
Uniprot ID
P21453
Gene Name
S1PR1
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
IC50 = 4.9 nM
   TI
   LI
   LO
   TS