Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Beta-secretase 1' and Ligand = 'BDBM149309'   

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))	BDBM149309 (US8962674, CU520) Show SMILES Oc1ccc(CCC(=O)CC(=O)\C=C\c2ccc3ccn(Cc4ccccc4)c3c2)cc1 Show InChI InChI=1S/C28H25NO3/c30-25-12-7-21(8-13-25)9-14-26(31)19-27(32)15-10-22-6-11-24-16-17-29(28(24)18-22)20-23-4-2-1-3-5-23/h1-8,10-13,15-18,30H,9,14,19-20H2/b15-10+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	610	n/a	n/a	n/a	n/a	4.5	37
Tokyo Institute of Technology; Kyoto University US Patent					Assay Description Compounds were dissolved in dimethylsulfoxide (DMSO), and further diluted in 0.1 M sodium acetate buffer (with 150 mM sodium chloride, pH 4.5). The s...				US Patent US8962674 (2015) BindingDB Entry DOI: 10.7270/Q2QJ7G1J
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