BDBM50305478 4-((2-amino-4-cyclohexyl-5-oxo-4-phenyl-4,5-dihydro-1H-imidazol-1-yl)methyl)cyclohexanecarboxylic acid::CHEMBL589891

SMILES: NC1=NC(C2CCCCC2)(C(=O)N1C[C@H]1CC[C@@H](CC1)C(O)=O)c1ccccc1

InChI Key: InChIKey=VENODDRXHDEEEG-XEDXNJDHSA-N

Data: 2 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 2 hits for monomerid = 50305478   

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
Beta-secretase 2 (Homo sapiens (Human))	BDBM50305478 (4-((2-amino-4-cyclohexyl-5-oxo-4-phenyl-4,5-dihydr...) Show SMILES NC1=NC(C2CCCCC2)(C(=O)N1C[C@H]1CC[C@@H](CC1)C(O)=O)c1ccccc1 |r,wU:14.15,wD:17.22,t:1,(23.53,3.34,;24.5,2.14,;24.09,.65,;25.38,-.19,;26.71,-.96,;26.7,-2.49,;28.03,-3.26,;29.36,-2.5,;29.36,-.96,;28.03,-.19,;26.58,.77,;28.07,.37,;26.03,2.21,;26.82,3.54,;28.36,3.52,;29.14,4.84,;30.69,4.81,;31.44,3.47,;30.64,2.15,;29.11,2.17,;32.98,3.45,;33.73,2.1,;33.77,4.77,;24.04,-.95,;22.71,-.16,;21.37,-.92,;21.36,-2.46,;22.7,-3.24,;24.03,-2.48,)| Show InChI InChI=1S/C23H31N3O3/c24-22-25-23(18-7-3-1-4-8-18,19-9-5-2-6-10-19)21(29)26(22)15-16-11-13-17(14-12-16)20(27)28/h1,3-4,7-8,16-17,19H,2,5-6,9-15H2,(H2,24,25)(H,27,28)/t16-,17-,23?	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of human BACE2 by FRET assay				Bioorg Med Chem Lett 20: 632-5 (2010) Article DOI: 10.1016/j.bmcl.2009.11.052 BindingDB Entry DOI: 10.7270/Q20Z73BN
					More data for this Ligand-Target Pair
Beta-secretase 1 (Homo sapiens (Human))	BDBM50305478 (4-((2-amino-4-cyclohexyl-5-oxo-4-phenyl-4,5-dihydr...) Show SMILES NC1=NC(C2CCCCC2)(C(=O)N1C[C@H]1CC[C@@H](CC1)C(O)=O)c1ccccc1 |r,wU:14.15,wD:17.22,t:1,(23.53,3.34,;24.5,2.14,;24.09,.65,;25.38,-.19,;26.71,-.96,;26.7,-2.49,;28.03,-3.26,;29.36,-2.5,;29.36,-.96,;28.03,-.19,;26.58,.77,;28.07,.37,;26.03,2.21,;26.82,3.54,;28.36,3.52,;29.14,4.84,;30.69,4.81,;31.44,3.47,;30.64,2.15,;29.11,2.17,;32.98,3.45,;33.73,2.1,;33.77,4.77,;24.04,-.95,;22.71,-.16,;21.37,-.92,;21.36,-2.46,;22.7,-3.24,;24.03,-2.48,)| Show InChI InChI=1S/C23H31N3O3/c24-22-25-23(18-7-3-1-4-8-18,19-9-5-2-6-10-19)21(29)26(22)15-16-11-13-17(14-12-16)20(27)28/h1,3-4,7-8,16-17,19H,2,5-6,9-15H2,(H2,24,25)(H,27,28)/t16-,17-,23?	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	390	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of human BACE1 by FRET assay				Bioorg Med Chem Lett 20: 632-5 (2010) Article DOI: 10.1016/j.bmcl.2009.11.052 BindingDB Entry DOI: 10.7270/Q20Z73BN
					More data for this Ligand-Target Pair