BDBM50333051 1-Adamantan-1-yl-3-{3-[4-(4-methanesulfonyl-piperazin-1-yl)-butoxy]-phenyl}-urea::CHEMBL1632484

SMILES: CS(=O)(=O)N1CCN(CCCCOc2cccc(NC(=O)NC34CC5CC(CC(C5)C3)C4)c2)CC1

InChI Key: InChIKey=JBNIQURVWZJAOQ-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50333051   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
EBifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50333051 (1-Adamantan-1-yl-3-{3-[4-(4-methanesulfonyl-pipera...) Show SMILES CS(=O)(=O)N1CCN(CCCCOc2cccc(NC(=O)NC34CC5CC(CC(C5)C3)C4)c2)CC1 |THB:21:22:25:29.27.28,30:28:25:31.22.23,30:22:25:29.27.28,27:26:23:29.28.30,27:28:25.26.31:23| Show InChI InChI=1S/C26H40N4O4S/c1-35(32,33)30-10-8-29(9-11-30)7-2-3-12-34-24-6-4-5-23(16-24)27-25(31)28-26-17-20-13-21(18-26)15-22(14-20)19-26/h4-6,16,20-22H,2-3,7-15,17-19H2,1H3,(H2,27,28,31)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human recombinant soluble epoxide hydrolase expressed in baculovirus expression system by fluorimetric assay				J Med Chem 53: 8376-8386 (2010) Article DOI: 10.1021/jm101087u BindingDB Entry DOI: 10.7270/Q2D79BNT
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