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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sphingosine 1-phosphate receptor 3' and Ligand = 'BDBM50361879'   
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 3


(Homo sapiens (Human))
BDBM50361879
PNG
(CHEMBL1938925)
Show SMILES CC(c1ccc2nc(sc2c1)-c1ccc(CN2CC(C2)C(O)=O)cc1F)c1ccccn1
Show InChI InChI=1S/C25H22FN3O2S/c1-15(21-4-2-3-9-27-21)17-6-8-22-23(11-17)32-24(28-22)19-7-5-16(10-20(19)26)12-29-13-18(14-29)25(30)31/h2-11,15,18H,12-14H2,1H3,(H,30,31)
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Similars

Article
PubMed
n/an/an/an/a>2.50E+4n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human S1P3 receptor expressed in CHO cells coexpressing Gq/i5 protein by calcium flux assay


Bioorg Med Chem Lett 22: 628-33 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.069
BindingDB Entry DOI: 10.7270/Q2T72HW3
More data for this
Ligand-Target Pair