Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Beta-secretase 1' and Ligand = 'BDBM100988'   

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))	BDBM100988 (US8507479, 11 | US8541408, 11) Show SMILES Cc1cc(C(=O)Nc2cccc(c2)[C@]2(C)CCSC(N)=N2)c(C)s1 |r,c:20| Show InChI InChI=1S/C18H21N3OS2/c1-11-9-15(12(2)24-11)16(22)20-14-6-4-5-13(10-14)18(3)7-8-23-17(19)21-18/h4-6,9-10H,7-8H2,1-3H3,(H2,19,21)(H,20,22)/t18-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	170	n/a	n/a	n/a	n/a	7.0	n/a
Shionogi & Co., Ltd. US Patent					Assay Description Inhibition assay using human BACE-1.				US Patent US8541408 (2013) BindingDB Entry DOI: 10.7270/Q2KK99D8
					More data for this Ligand-Target Pair
Beta-secretase 1 (Homo sapiens (Human))	BDBM100988 (US8507479, 11 | US8541408, 11) Show SMILES Cc1cc(C(=O)Nc2cccc(c2)[C@]2(C)CCSC(N)=N2)c(C)s1 |r,c:20| Show InChI InChI=1S/C18H21N3OS2/c1-11-9-15(12(2)24-11)16(22)20-14-6-4-5-13(10-14)18(3)7-8-23-17(19)21-18/h4-6,9-10H,7-8H2,1-3H3,(H2,19,21)(H,20,22)/t18-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
Shionogi & Co., Ltd. US Patent					Assay Description Beta-Secretase inhibition assay.				US Patent US8507479 (2013) BindingDB Entry DOI: 10.7270/Q2KS6Q6G
					More data for this Ligand-Target Pair