Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Beta-secretase 1' and Ligand = 'BDBM103386'   

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))	BDBM103386 (US8546380, 417 | US8633188, 417) Show SMILES CCOC(=O)C=Cc1cccc(c1)C1(C)CCSC(N)=N1 |w:6.6,c:20| Show InChI InChI=1S/C16H20N2O2S/c1-3-20-14(19)8-7-12-5-4-6-13(11-12)16(2)9-10-21-15(17)18-16/h4-8,11H,3,9-10H2,1-2H3,(H2,17,18)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	5.0	30
Shionogi & Co., Ltd. US Patent					Assay Description Zero point five μL of the test compounds (dissolved in N,N′-dimethylsulfoxide) were incubated with 48.5 μL of the fluorescence-quench...				US Patent US8633188 (2014) BindingDB Entry DOI: 10.7270/Q2FT8JQ0
					More data for this Ligand-Target Pair
Beta-secretase 1 (Homo sapiens (Human))	BDBM103386 (US8546380, 417 | US8633188, 417) Show SMILES CCOC(=O)C=Cc1cccc(c1)C1(C)CCSC(N)=N1 |w:6.6,c:20| Show InChI InChI=1S/C16H20N2O2S/c1-3-20-14(19)8-7-12-5-4-6-13(11-12)16(2)9-10-21-15(17)18-16/h4-8,11H,3,9-10H2,1-2H3,(H2,17,18)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	5.0	30
Shionogi & Co., Ltd. US Patent					Assay Description Inhibition assay using beta-Secretase activity.				US Patent US8546380 (2013) BindingDB Entry DOI: 10.7270/Q2HQ3XJ0
					More data for this Ligand-Target Pair