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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 = 'BDBM50203773'   
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))
BDBM50203773
PNG
(5-(4-carboxy-2-(4-(4-(heptadecylamino)phenyl)-2,4-...)
Show SMILES CCCCCCCCCCCCCCCCCNc1ccc(cc1)C(=O)CC(=O)Cc1cc(ccc1Oc1cc(cc(c1)C(O)=O)C(O)=O)C(O)=O
Show InChI InChI=1S/C42H53NO9/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-43-35-20-17-30(18-21-35)38(45)29-36(44)26-32-24-31(40(46)47)19-22-39(32)52-37-27-33(41(48)49)25-34(28-37)42(50)51/h17-22,24-25,27-28,43H,2-16,23,26,29H2,1H3,(H,46,47)(H,48,49)(H,50,51)
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UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.60E+3n/an/an/an/an/an/a



TOA EIYO Ltd.

Curated by ChEMBL


Assay Description
Antagonist activity against human S1P3 receptor assessed as inhibition of S1P-induced intracellular calcium mobilization in CHO-K1 cells


J Med Chem 50: 442-54 (2007)


Article DOI: 10.1021/jm060834d
BindingDB Entry DOI: 10.7270/Q2NG4Q84
More data for this
Ligand-Target Pair