Brief Information of the Compound and Protein
Compound Name
5-[5-[4-[(2R)-2-amino-3-hydroxypropoxy]-2-chloro-5-fluorophenyl]-1,3,4-thiadiazol-2-yl]-2-propan-2-yloxypyridine-3-carbonitrile
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PubChem ID
CID: 124173275
Canonical SMILES
CC(C)Oc1ncc(cc1C#N)-c1nnc(s1)-c1cc(F)c(OC[C@H](N)CO)cc1Cl
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Compound Formula C20H19ClFN5O3S
Compound Structure
Protein Name
Sphingosine 1-phosphate receptor 1
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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Lipid-like ligand receptor (family A GPCR)
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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
CL000043 U2OS Homo sapiens (Human)  1
1
EC50 = 13 nM
   TI
   LI
   LO
   TS