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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 = 'BDBM50419938'   
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))
BDBM50419938
PNG
(CHEMBL2011708)
Show SMILES CCCCN(C(=O)c1ccccc1)c1nnc(s1)-c1cccnc1
Show InChI InChI=1S/C18H18N4OS/c1-2-3-12-22(17(23)14-8-5-4-6-9-14)18-21-20-16(24-18)15-10-7-11-19-13-15/h4-11,13H,2-3,12H2,1H3
PDB

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KEGG

UniProtKB/SwissProt

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GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>1.00E+4n/an/an/an/a



GlaxoSmithKline Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human S1P3R expressed in HEK293T cells by Ca(2+) mobilization assay


Bioorg Med Chem Lett 22: 2456-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.016
BindingDB Entry DOI: 10.7270/Q2571D1C
More data for this
Ligand-Target Pair