Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Beta-secretase 1' and Ligand = 'BDBM210090'   

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))	BDBM210090 (US9270353, 49) Show SMILES NC1=NC(CCS1)(c1cccc(NC(=O)c2cnc(OCC#C)cn2)c1)C(F)(F)F |t:1| Show InChI InChI=1S/C19H16F3N5O2S/c1-2-7-29-15-11-24-14(10-25-15)16(28)26-13-5-3-4-12(9-13)18(19(20,21)22)6-8-30-17(23)27-18/h1,3-5,9-11H,6-8H2,(H2,23,27)(H,26,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<1.00E+3	n/a	n/a	n/a	n/a	5.0	n/a
Shionogi & Co., Ltd. US Patent					Assay Description 48.5 μL of substrate peptide solution (Biotin-XSEVNLDAEFRHDSGC-Eu: X=ε-amino-n-capronic acid, Eu=Europium cryptate) was added to each well ...				US Patent US9273053 (2016) BindingDB Entry DOI: 10.7270/Q24Q7SVG
					More data for this Ligand-Target Pair
Beta-secretase 1 (Homo sapiens (Human))	BDBM210090 (US9270353, 49) Show SMILES NC1=NC(CCS1)(c1cccc(NC(=O)c2cnc(OCC#C)cn2)c1)C(F)(F)F |t:1| Show InChI InChI=1S/C19H16F3N5O2S/c1-2-7-29-15-11-24-14(10-25-15)16(28)26-13-5-3-4-12(9-13)18(19(20,21)22)6-8-30-17(23)27-18/h1,3-5,9-11H,6-8H2,(H2,23,27)(H,26,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<1.00E+3	n/a	n/a	n/a	n/a	5.0	n/a
Shionogi & Co., Ltd. US Patent					Assay Description 48.5 μL of substrate peptide solution (Biotin-XSEVNLDAEFRHDSGC-Eu: X=ε-amino-n-capronic acid, Eu=Europium cryptate) was added to each well ...				US Patent US9273053 (2016) BindingDB Entry DOI: 10.7270/Q24Q7SVG
					More data for this Ligand-Target Pair