Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Beta-secretase 1' and Ligand = 'BDBM38230'   

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))	BDBM38230 (US8546380, 309 | US8633188, 309) Show SMILES Cc1cnc(cn1)C(=O)Nc1cccc(c1)C1(C)CCSC(N)=N1 |c:24| Show InChI InChI=1S/C17H19N5OS/c1-11-9-20-14(10-19-11)15(23)21-13-5-3-4-12(8-13)17(2)6-7-24-16(18)22-17/h3-5,8-10H,6-7H2,1-2H3,(H2,18,22)(H,21,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	833	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))	BDBM38230 (US8546380, 309 | US8633188, 309) Show SMILES Cc1cnc(cn1)C(=O)Nc1cccc(c1)C1(C)CCSC(N)=N1 |c:24| Show InChI InChI=1S/C17H19N5OS/c1-11-9-20-14(10-19-11)15(23)21-13-5-3-4-12(8-13)17(2)6-7-24-16(18)22-17/h3-5,8-10H,6-7H2,1-2H3,(H2,18,22)(H,21,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	833	n/a	n/a	n/a	n/a	n/a	n/a
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