Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Beta-secretase 1' and Ligand = 'BDBM50398297'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Beta-secretase 1 (Homo sapiens (Human))	BDBM50398297 (CHEMBL2177310) Show SMILES COc1ccc(cc1)C1(COC(N)=N1)c1cccc(c1)-c1cc(Cl)ccc1F |c:13| Show InChI InChI=1S/C22H18ClFN2O2/c1-27-18-8-5-15(6-9-18)22(13-28-21(25)26-22)16-4-2-3-14(11-16)19-12-17(23)7-10-20(19)24/h2-12H,13H2,1H3,(H2,25,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.95E+3	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant BACE1 using Glu-Ile-Asp-Leu-Met-Val-Leu-Asp as substrate incubated for 60 mins prior to substrate addition measured a...				J Med Chem 55: 9156-69 (2012) Article DOI: 10.1021/jm300598e BindingDB Entry DOI: 10.7270/Q2S46T3P
					More data for this Ligand-Target Pair
Beta-secretase 1 (Homo sapiens (Human))	BDBM50398297 (CHEMBL2177310) Show SMILES COc1ccc(cc1)C1(COC(N)=N1)c1cccc(c1)-c1cc(Cl)ccc1F |c:13| Show InChI InChI=1S/C22H18ClFN2O2/c1-27-18-8-5-15(6-9-18)22(13-28-21(25)26-22)16-4-2-3-14(11-16)19-12-17(23)7-10-20(19)24/h2-12H,13H2,1H3,(H2,25,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Inhibition of BACE1 in human HEK293 cells expressing APP Swedish mutant assessed as reduction in amyloid beta 40 production after overnight incubatio...				J Med Chem 55: 9156-69 (2012) Article DOI: 10.1021/jm300598e BindingDB Entry DOI: 10.7270/Q2S46T3P
					More data for this Ligand-Target Pair