BDBM50196656 12-(3-adamantan-1-yl-ureido)-dodecanoic acid adamantan-1-yl ester::CHEMBL390796

SMILES: O=C(CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2)OC12CC3CC(CC(C3)C1)C2

InChI Key: InChIKey=GBDVIQNWTAQROA-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50196656   

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))	BDBM50196656 (12-(3-adamantan-1-yl-ureido)-dodecanoic acid adama...) Show SMILES O=C(CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2)OC12CC3CC(CC(C3)C1)C2 |TLB:16:17:20:24.23.22,27:28:31:35.34.33,THB:25:17:20:24.23.22,25:23:20:26.18.17,29:30:33:37.28.36,29:28:31.30.35:33,36:28:31:35.34.33,36:34:31:37.29.28,18:19:22:26.17.25,18:17:20.19.24:22| Show InChI InChI=1S/C33H54N2O3/c36-30(38-33-21-27-15-28(22-33)17-29(16-27)23-33)10-8-6-4-2-1-3-5-7-9-11-34-31(37)35-32-18-24-12-25(19-32)14-26(13-24)20-32/h24-29H,1-23H2,(H2,34,35,37)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.5	n/a	n/a	n/a	n/a	n/a	n/a
Department of Entomology and University of California Davis Cancer Center Curated by ChEMBL					Assay Description Inhibition of human soluble epoxide hydrolase by fluorescent based assay				Bioorg Med Chem 15: 312-23 (2006) Article DOI: 10.1016/j.bmc.2006.09.057 BindingDB Entry DOI: 10.7270/Q26D5SNJ
					More data for this Ligand-Target Pair
Soluble epoxide hydrolase (sEH) (Mus musculus (Mouse))	BDBM50196656 (12-(3-adamantan-1-yl-ureido)-dodecanoic acid adama...) Show SMILES O=C(CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2)OC12CC3CC(CC(C3)C1)C2 |TLB:16:17:20:24.23.22,27:28:31:35.34.33,THB:25:17:20:24.23.22,25:23:20:26.18.17,29:30:33:37.28.36,29:28:31.30.35:33,36:28:31:35.34.33,36:34:31:37.29.28,18:19:22:26.17.25,18:17:20.19.24:22| Show InChI InChI=1S/C33H54N2O3/c36-30(38-33-21-27-15-28(22-33)17-29(16-27)23-33)10-8-6-4-2-1-3-5-7-9-11-34-31(37)35-32-18-24-12-25(19-32)14-26(13-24)20-32/h24-29H,1-23H2,(H2,34,35,37)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
Department of Entomology and University of California Davis Cancer Center Curated by ChEMBL					Assay Description Inhibition of mouse soluble epoxide hydrolase by spectrometric based assay				Bioorg Med Chem 15: 312-23 (2006) Article DOI: 10.1016/j.bmc.2006.09.057 BindingDB Entry DOI: 10.7270/Q26D5SNJ
					More data for this Ligand-Target Pair
EBifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50196656 (12-(3-adamantan-1-yl-ureido)-dodecanoic acid adama...) Show SMILES O=C(CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2)OC12CC3CC(CC(C3)C1)C2 |TLB:16:17:20:24.23.22,27:28:31:35.34.33,THB:25:17:20:24.23.22,25:23:20:26.18.17,29:30:33:37.28.36,29:28:31.30.35:33,36:28:31:35.34.33,36:34:31:37.29.28,18:19:22:26.17.25,18:17:20.19.24:22| Show InChI InChI=1S/C33H54N2O3/c36-30(38-33-21-27-15-28(22-33)17-29(16-27)23-33)10-8-6-4-2-1-3-5-7-9-11-34-31(37)35-32-18-24-12-25(19-32)14-26(13-24)20-32/h24-29H,1-23H2,(H2,34,35,37)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
Department of Entomology and University of California Davis Cancer Center Curated by ChEMBL					Assay Description Inhibition of human soluble epoxide hydrolase by spectrometric based assay				Bioorg Med Chem 15: 312-23 (2006) Article DOI: 10.1016/j.bmc.2006.09.057 BindingDB Entry DOI: 10.7270/Q26D5SNJ
					More data for this Ligand-Target Pair