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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 = 'BDBM50494320'   
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))
BDBM50494320
PNG
(CHEMBL1995815)
Show SMILES CC1CCCCC1N(C1CCCC1)C(=O)c1cc(on1)C1CC1
Show InChI InChI=1S/C19H28N2O2/c1-13-6-2-5-9-17(13)21(15-7-3-4-8-15)19(22)16-12-18(23-20-16)14-10-11-14/h12-15,17H,2-11H2,1H3
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PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a>5.00E+4n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at S1P1 receptor (unknown origin)


Bioorg Med Chem Lett 23: 6346-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.09.075
BindingDB Entry DOI: 10.7270/Q2668H4K
More data for this
Ligand-Target Pair