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BDBM50351229 CHEMBL1818402

SMILES: CCCCCCCNC(=O)NC1C2CC3CC(C2)CC1C3

InChI Key: InChIKey=BAZLJFJMIJLXEI-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50351229   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
EBifunctional epoxide hydrolase 2


(Homo sapiens (Human))		BDBM50351229
PNG
(CHEMBL1818402)
Show SMILES CCCCCCCNC(=O)NC1C2CC3CC(C2)CC1C3 |TLB:20:19:17:13.14.15,THB:20:14:11.19.18:17,15:14:11:18.16.17,15:16:11:13.20.14,10:11:17:13.14.15,(27.29,-48.43,;28.62,-49.2,;29.96,-48.43,;31.29,-49.2,;32.62,-48.43,;33.96,-49.2,;35.29,-48.43,;36.63,-49.2,;37.96,-48.42,;37.96,-46.88,;39.3,-49.19,;40.63,-48.42,;41.83,-47.14,;43.15,-47.63,;44.54,-47.29,;44.56,-45.76,;43.16,-45.18,;41.82,-45.66,;42.12,-46.42,;42.12,-48,;43.54,-48.56,)|
Show InChI InChI=1S/C18H32N2O/c1-2-3-4-5-6-7-19-18(21)20-17-15-9-13-8-14(11-15)12-16(17)10-13/h13-17H,2-12H2,1H3,(H2,19,20,21)
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Article
PubMed
n/an/a 0.5n/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