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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Epoxide hydratase' and Monomerid = 50317309   
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))
BDBM50317309
PNG
(1-(4-(3-morpholinopropylsulfonyl)phenyl)-3-phenylu...)
Show SMILES O=C(Nc1ccccc1)Nc1ccc(cc1)S(=O)(=O)CCCN1CCOCC1
Show InChI InChI=1S/C20H25N3O4S/c24-20(21-17-5-2-1-3-6-17)22-18-7-9-19(10-8-18)28(25,26)16-4-11-23-12-14-27-15-13-23/h1-3,5-10H,4,11-16H2,(H2,21,22,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 54n/an/an/an/an/an/a



Ar£te Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibition of soluble epoxide hydrolase by fluorescence assay


Bioorg Med Chem Lett 20: 2740-4 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.074
BindingDB Entry DOI: 10.7270/Q28K798X
More data for this
Ligand-Target Pair