Target
Sphingosine 1-phosphate receptor 1
Ligand
BDBM50045328
Substrate
n/a
Meas. Tech.
ChEMBL_1458115 (CHEMBL3367912)
EC50
2.8±n/a nM
Citation
 Tsuji, TSuzuki, KNakamura, TGoto, TSekiguchi, YIkeda, TFukuda, TTakemoto, TMizuno, YKimura, TKawase, YNara, FKagari, TShimozato, TYahara, CInaba, SHonda, TIzumi, TTamura, MNishi, T Synthesis and SAR studies of benzyl ether derivatives as potent orally active S1P1 agonists. Bioorg Med Chem 22:4246-56 (2014) [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:
BDBM50045328
Synonyms:
CHEMBL3311350
Type:
Small organic molecule
Emp. Form.:
C22H29FNO6P
Mol. Mass.:
453.4409
SMILES:
Cc1ccc(CCCC(=O)c2ccc(COC[C@@](C)(N)COP(O)(O)=O)c(F)c2)cc1 |r|
Structure:
Search PDB for entries with ligand similarity: