Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Beta-secretase 1' and Ligand = 'BDBM101029'   

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))	BDBM101029 (US8507479, 669) Show SMILES C[C@]1(CCSC(N)=N1)c1cc(NC(=O)c2coc(n2)C(F)(F)F)ccc1F |r,c:6| Show InChI InChI=1S/C16H14F4N4O2S/c1-15(4-5-27-14(21)24-15)9-6-8(2-3-10(9)17)22-12(25)11-7-26-13(23-11)16(18,19)20/h2-3,6-7H,4-5H2,1H3,(H2,21,24)(H,22,25)/t15-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	10	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))	BDBM101029 (US8507479, 669) Show SMILES C[C@]1(CCSC(N)=N1)c1cc(NC(=O)c2coc(n2)C(F)(F)F)ccc1F |r,c:6| Show InChI InChI=1S/C16H14F4N4O2S/c1-15(4-5-27-14(21)24-15)9-6-8(2-3-10(9)17)22-12(25)11-7-26-13(23-11)16(18,19)20/h2-3,6-7H,4-5H2,1H3,(H2,21,24)(H,22,25)/t15-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	10	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