Brief Information of the Compound and Protein
Compound Name
 Compound Info 
US9216972, 16
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 PubChem ID
CID: 53234382
SID: 124343558
Canonical SMILES
CC(C)Oc1ccc(cc1C#N)-c1onc-2c1CCc1cc(CNCCC(O)=O)ccc-21
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Compound Formula C25H25N3O4
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 = 24 nM
   TI
   LI
   LO
   TS