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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostaglandin E2 receptor' and Ligand = 'BDBM50193929'   
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
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50193929
PNG
(3-(2-(2-(benzyloxy)-5-methylcinnamyl)phenyl)acryli...)
Show SMILES Cc1ccc(OCc2ccccc2)c(\C=C\Cc2ccccc2\C=C\C(O)=O)c1
Show InChI InChI=1S/C26H24O3/c1-20-14-16-25(29-19-21-8-3-2-4-9-21)24(18-20)13-7-12-22-10-5-6-11-23(22)15-17-26(27)28/h2-11,13-18H,12,19H2,1H3,(H,27,28)/b13-7+,17-15+
PDB

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PC cid
PC sid
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Article
PubMed
9n/an/an/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Binding affinity to EP3 receptor


Bioorg Med Chem Lett 16: 5639-42 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.025
BindingDB Entry DOI: 10.7270/Q2NS0VQ6
More data for this
Ligand-Target Pair