BDBM50057633 CHEMBL3322821::US9127027, 28::US9422318, 28

SMILES: CCCCCNC(=O)NCCCC\C=C/CCCCCCc1noc(=S)[nH]1

InChI Key: InChIKey=BDTWACPGBSEJAX-ALCCZGGFSA-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 = 50057633   

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
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057633 (CHEMBL3322821 | US9127027, 28 | US9422318, 28) Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCc1noc(=S)[nH]1 Show InChI InChI=1S/C20H36N4O2S/c1-2-3-13-16-21-19(25)22-17-14-11-9-7-5-4-6-8-10-12-15-18-23-20(27)26-24-18/h5,7H,2-4,6,8-17H2,1H3,(H2,21,22,25)(H,23,24,27)/b7-5-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System US Patent					Assay Description Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...				US Patent US9127027 (2015) BindingDB Entry DOI: 10.7270/Q2833QTQ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057633 (CHEMBL3322821 | US9127027, 28 | US9422318, 28) Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCc1noc(=S)[nH]1 Show InChI InChI=1S/C20H36N4O2S/c1-2-3-13-16-21-19(25)22-17-14-11-9-7-5-4-6-8-10-12-15-18-23-20(27)26-24-18/h5,7H,2-4,6,8-17H2,1H3,(H2,21,22,25)(H,23,24,27)/b7-5-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057633 (CHEMBL3322821 | US9127027, 28 | US9422318, 28) Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCc1noc(=S)[nH]1 Show InChI InChI=1S/C20H36N4O2S/c1-2-3-13-16-21-19(25)22-17-14-11-9-7-5-4-6-8-10-12-15-18-23-20(27)26-24-18/h5,7H,2-4,6,8-17H2,1H3,(H2,21,22,25)(H,23,24,27)/b7-5-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System US Patent					Assay Description Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...				US Patent US9422318 (2016) BindingDB Entry DOI: 10.7270/Q2BV7FH3
					More data for this Ligand-Target Pair