Reaction Details Report a problem with these data
Target
Sphingosine 1-phosphate receptor 1
Ligand
BDBM264683
Substrate
n/a
Meas. Tech.
BCA Protein Assay
pH
7.4±n/a
Temperature
298.15±n/a K
IC50
4.70±n/a nM
Comments
extracted
Citation
 Inoue, H; Ohno, K; Nakamura, T; Ohsawa, Y Aniline derivative, pharmaceutical composition containing same, and use thereof US Patent  US9718771 Publication Date 8/1/2017 
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:
BDBM264683
Synonyms:
US9718771, 2-18
Type:
Small organic molecule
Emp. Form.:
C24H29ClN2O3
Mol. Mass.:
428.952
SMILES:
CCN(C1CCc2c1ccc(OC)c2CN1CC(C1)C(O)=O)c1ccc(Cl)c(C)c1
Structure:
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