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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 = 'BDBM50419990'   
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))
BDBM50419990
PNG
(CHEMBL2018314)
Show SMILES OC(=O)CCc1c[nH]c2c(cccc12)-c1noc(n1)C1CCCCC1
Show InChI InChI=1S/C19H21N3O3/c23-16(24)10-9-13-11-20-17-14(13)7-4-8-15(17)18-21-19(25-22-18)12-5-2-1-3-6-12/h4,7-8,11-12,20H,1-3,5-6,9-10H2,(H,23,24)
PDB

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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 S1P3 receptor assessed as Ca2+ mobilization by GeneBLAzer assay


Bioorg Med Chem Lett 22: 2794-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.083
BindingDB Entry DOI: 10.7270/Q29G5P3R
More data for this
Ligand-Target Pair