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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Epoxide hydratase' and Monomerid = 50310790   
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
Epoxide hydratase


(Homo sapiens (Human))
BDBM50310790
PNG
(CHEMBL1080076 | N-(biphenyl-4-yl)-3-methyl-3-pheny...)
Show SMILES CC1(CCCN(C1)C(=O)Nc1ccc(cc1)-c1ccccc1)c1ccccc1
Show InChI InChI=1S/C25H26N2O/c1-25(22-11-6-3-7-12-22)17-8-18-27(19-25)24(28)26-23-15-13-21(14-16-23)20-9-4-2-5-10-20/h2-7,9-16H,8,17-19H2,1H3,(H,26,28)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human soluble epoxide hydrolase


Bioorg Med Chem Lett 19: 5314-20 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.138
BindingDB Entry DOI: 10.7270/Q2S75GFP
More data for this
Ligand-Target Pair