BDBM50234645 CHEMBL253865::N-((2S,3S)-4-(3-(2H-tetrazol-5-yl)phenylamino)-3-hydroxy-4-oxo-1-phenylbutan-2-yl)-4-oxo-6-((S)-4-phenyloxazolidine-3-carbonyl)-1,4-dihydropyridine-2-carboxamide

SMILES: O[C@@H]([C@H](Cc1ccccc1)NC(=O)c1cc(O)cc(n1)C(=O)N1COC[C@@H]1c1ccccc1)C(=O)Nc1cccc(c1)-c1nnn[nH]1

InChI Key: InChIKey=NORLMBBEWXGLPH-OYFGVDPJSA-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 = 50234645   

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 1 (Homo sapiens (Human))	BDBM50234645 (CHEMBL253865 | N-((2S,3S)-4-(3-(2H-tetrazol-5-yl)p...) Show SMILES O[C@@H]([C@H](Cc1ccccc1)NC(=O)c1cc(O)cc(n1)C(=O)N1COC[C@@H]1c1ccccc1)C(=O)Nc1cccc(c1)-c1nnn[nH]1 |r| Show InChI InChI=1S/C33H30N8O6/c42-24-16-26(35-27(17-24)33(46)41-19-47-18-28(41)21-10-5-2-6-11-21)31(44)36-25(14-20-8-3-1-4-9-20)29(43)32(45)34-23-13-7-12-22(15-23)30-37-39-40-38-30/h1-13,15-17,25,28-29,43H,14,18-19H2,(H,34,45)(H,35,42)(H,36,44)(H,37,38,39,40)/t25-,28+,29-/m0/s1	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	360	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human recombinant Arg235 region of BACE1 by FRET assay				Bioorg Med Chem Lett 19: 2435-9 (2009) Article DOI: 10.1016/j.bmcl.2009.03.049 BindingDB Entry DOI: 10.7270/Q27D2V1G
					More data for this Ligand-Target Pair
Beta-secretase 1 (Homo sapiens (Human))	BDBM50234645 (CHEMBL253865 | N-((2S,3S)-4-(3-(2H-tetrazol-5-yl)p...) Show SMILES O[C@@H]([C@H](Cc1ccccc1)NC(=O)c1cc(O)cc(n1)C(=O)N1COC[C@@H]1c1ccccc1)C(=O)Nc1cccc(c1)-c1nnn[nH]1 |r| Show InChI InChI=1S/C33H30N8O6/c42-24-16-26(35-27(17-24)33(46)41-19-47-18-28(41)21-10-5-2-6-11-21)31(44)36-25(14-20-8-3-1-4-9-20)29(43)32(45)34-23-13-7-12-22(15-23)30-37-39-40-38-30/h1-13,15-17,25,28-29,43H,14,18-19H2,(H,34,45)(H,35,42)(H,36,44)(H,37,38,39,40)/t25-,28+,29-/m0/s1	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	360	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human recombinant BACE1 by FRET assay				Bioorg Med Chem Lett 18: 1643-7 (2008) Article DOI: 10.1016/j.bmcl.2008.01.056 BindingDB Entry DOI: 10.7270/Q2J38S96
					More data for this Ligand-Target Pair