Target
Sphingosine 1-phosphate receptor 1
Ligand
BDBM50494312
Substrate
n/a
Meas. Tech.
ChEMBL_1276214 (CHEMBL3089537)
EC50
44900±n/a nM
Citation
 Guerrero, MPoddutoori, RUrbano, MPeng, XSpicer, TPChase, PSHodder, PSSchaeffer, MTBrown, SRosen, HRoberts, E Discovery, design and synthesis of a selective S1P(3) receptor allosteric agonist. Bioorg Med Chem Lett 23:6346-9 (2013) [PubMed]  Article
Target
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:
MGPTSVPLVKAHRSSVSDYVNYDIIVRHYNYTGKLNISADKENSIKLTSVVFILICCFIILENIFVLLTIWKTKKFHRPMYYFIGNLALSDLLAGVAYTANLLLSGATTYKLTPAQWFLREGSMFVALSASVFSLLAIAIERYITMLKMKLHNGSNNFRLFLLISACWVISLILGGLPIMGWNCISALSSCSTVLPLYHKHYILFCTTVFTLLLLSIVILYCRIYSLVRTRSRRLTFRKNISKASRSSEKSLALLKTVIIVLSVFIACWAPLFILLLLDVGCKVKTCDILFRAEYFLVLAVLNSGTNPIIYTLTNKEMRRAFIRIMSCCKCPSGDSAGKFKRPIIAGMEFSRSKSDNSSHPQKDEGDNPETIMSSGNVNSSS
  
Inhibitor
Name:
BDBM50494312
Synonyms:
CHEMBL3087666
Type:
Small organic molecule
Emp. Form.:
C20H18N2O2
Mol. Mass.:
318.3691
SMILES:
O=C(N(Cc1ccccc1)c1ccccc1)c1cc(on1)C1CC1
Structure:
Search PDB for entries with ligand similarity: