Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetSphingosine 1-phosphate receptor 1
LigandBDBM50335451
Substrate/Competitorn/a
Meas. Tech.ChEMBL_701955 (CHEMBL1657527)
EC50 580±n/a nM
Citation Saha, AKYu, XLin, JLobera, MSharadendu, AChereku, SSchutz, NSegal, DMarantz, YMcCauley, DMiddleton, SSiu, JBörli, RWBuys, JHorner, MSalyers, KSchrag, MVargas, HMXu, YMcElvain, M Benzofuran Derivatives as Potent, Orally Active S1P1 Receptor Agonists: A Preclinical Lead Molecule for MS ACS Med Chem Lett2:97-101 (2011) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Sphingosine 1-phosphate receptor 1
Name:Sphingosine 1-phosphate receptor 1
Synonyms:CHEDG1 | EDG1 | Endothelial differentiation G-protein coupled receptor 1 | S1P receptor | S1P1 | S1PR1 | S1PR1_HUMAN | Sphingosine 1-phosphate receptor 1 (S1PR1) | Sphingosine 1-phosphate receptor Edg-1
Type:Enzyme
Mol. Mass.:42836.02
Organism:Homo sapiens (Human)
Description:P21453
Residue:382
Sequence:
MGPTSVPLVKAHRSSVSDYVNYDIIVRHYNYTGKLNISADKENSIKLTSVVFILICCFII
LENIFVLLTIWKTKKFHRPMYYFIGNLALSDLLAGVAYTANLLLSGATTYKLTPAQWFLR
EGSMFVALSASVFSLLAIAIERYITMLKMKLHNGSNNFRLFLLISACWVISLILGGLPIM
GWNCISALSSCSTVLPLYHKHYILFCTTVFTLLLLSIVILYCRIYSLVRTRSRRLTFRKN
ISKASRSSEKSLALLKTVIIVLSVFIACWAPLFILLLLDVGCKVKTCDILFRAEYFLVLA
VLNSGTNPIIYTLTNKEMRRAFIRIMSCCKCPSGDSAGKFKRPIIAGMEFSRSKSDNSSH
PQKDEGDNPETIMSSGNVNSSS
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50335451
n/a
NameBDBM50335451
Synonyms:1-(4-(5-phenethylbenzofuran-2-yl)benzyl)azetidine-3-carboxylic acid | CHEMBL1651705
TypeSmall organic molecule
Emp. Form.C27H25NO3
Mol. Mass.411.4923
SMILESOC(=O)C1CN(Cc2ccc(cc2)-c2cc3cc(CCc4ccccc4)ccc3o2)C1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: