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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sphingosine 1-phosphate receptor 1' and Ligand = 'BDBM50357799'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM50357799
PNG
(CHEMBL1916576)
Show SMILES COc1ccc(cc1C)-c1nc(no1)-c1ccc2N(CCc2c1)C(=O)CCC(O)=O
Show InChI InChI=1S/C22H21N3O5/c1-13-11-16(4-6-18(13)29-2)22-23-21(24-30-22)15-3-5-17-14(12-15)9-10-25(17)19(26)7-8-20(27)28/h3-6,11-12H,7-10H2,1-2H3,(H,27,28)
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Similars

Article
PubMed
n/an/an/an/a 18n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human S1P1 receptor expressed in HEK293 cells assessed as inhibition of forskolin-stimulated cAMP production after 1 hr by HTRF a...


Bioorg Med Chem Lett 21: 6013-8 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.110
BindingDB Entry DOI: 10.7270/Q24T6JSB
More data for this
Ligand-Target Pair