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BDBM50217477 CHEMBL243793::trans-4-{4-[3-(4-trifluoromethoxyphenyl)ureido]cyclohexyloxy}benzoic acid

SMILES: OC(=O)c1cccc(O[C@H]2CC[C@@H](CC2)NC(=O)Nc2ccc(OC(F)(F)F)cc2)c1

InChI Key: InChIKey=JFDGQMFABFYUOL-KOMQPUFPSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50217477   
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))		BDBM50217477
PNG
(CHEMBL243793 | trans-4-{4-[3-(4-trifluoromethoxyph...)
Show SMILES OC(=O)c1cccc(O[C@H]2CC[C@@H](CC2)NC(=O)Nc2ccc(OC(F)(F)F)cc2)c1 |wU:9.8,wD:12.15,(7.44,1.03,;8.16,2.39,;9.7,2.45,;7.34,3.7,;8.06,5.06,;7.23,6.37,;5.7,6.31,;4.99,4.95,;3.45,4.9,;2.73,3.53,;3.54,2.23,;2.83,.87,;1.28,.82,;.46,2.11,;1.18,3.48,;.56,-.55,;-.98,-.61,;-1.8,.7,;-1.69,-1.97,;-3.23,-2.03,;-4.05,-.73,;-5.58,-.79,;-6.3,-2.15,;-7.84,-2.21,;-8.66,-.91,;-9.45,.43,;-9.98,-1.71,;-7.34,-.13,;-5.47,-3.46,;-3.94,-3.39,;5.8,3.64,)|
Show InChI InChI=1S/C21H21F3N2O5/c22-21(23,24)31-17-10-6-15(7-11-17)26-20(29)25-14-4-8-16(9-5-14)30-18-3-1-2-13(12-18)19(27)28/h1-3,6-7,10-12,14,16H,4-5,8-9H2,(H,27,28)(H2,25,26,29)/t14-,16-
PDB

KEGG

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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 0.900n/an/an/an/an/an/a



University of California-Davis

Curated by ChEMBL


Assay Description
Inhibition of human recombinant soluble epoxide hydrolase

J Med Chem 50: 3825-40 (2007)


Article DOI: 10.1021/jm070270t
BindingDB Entry DOI: 10.7270/Q2TQ62BW
More data for this
Ligand-Target Pair