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BDBM50351210 CHEMBL1818420

SMILES: CC(C)CCOc1ccc(NC(=O)Nc2ccc(OCCC(C)C)cc2)cc1

InChI Key: InChIKey=XPXNJKSPAKCNKU-UHFFFAOYSA-N

Data: 1 IC50

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Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50351210   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50351210
PNG
(CHEMBL1818420)
Show SMILES CC(C)CCOc1ccc(NC(=O)Nc2ccc(OCCC(C)C)cc2)cc1
Show InChI InChI=1S/C23H32N2O3/c1-17(2)13-15-27-21-9-5-19(6-10-21)24-23(26)25-20-7-11-22(12-8-20)28-16-14-18(3)4/h5-12,17-18H,13-16H2,1-4H3,(H2,24,25,26)
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6.5n/an/an/an/an/an/a



St. Jude Children's Research Hospital

Curated by ChEMBL


Assay Description
Inhibition of human recombinant soluble epoxide hydrolase using CMNPC as substrate after 10 mins by fluorescent assay


Bioorg Med Chem 19: 5585-95 (2011)


Article DOI: 10.1016/j.bmc.2011.07.034
BindingDB Entry DOI: 10.7270/Q2V69JZ1
More data for this
Ligand-Target Pair