Reaction Details Report a problem with these data
Target
Sphingosine 1-phosphate receptor 1
Ligand
BDBM129591
Substrate
n/a
Meas. Tech.
Receptor Binding Assay
pH
7.4±n/a
Temperature
277.15±n/a K
Ki
0.6±n/a nM
Comments
extracted
Citation
 Quattropani, A; Baker-Glenn, C; Blackaby, W; Knight, C Pyrazole oxadiazole derivatives as S1P1 agonists US Patent  US8802663 Publication Date 8/12/2014 
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:
BDBM129591
Synonyms:
US8802663, 125
Type:
Small organic molecule
Emp. Form.:
C28H35N5O4
Mol. Mass.:
505.6086
SMILES:
OC(=O)C1CCN(Cc2ccc(cc2)-c2noc(n2)-c2cnn(C3CCCCC3)c2C2CCCO2)CC1
Structure:
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