Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Beta-secretase 2' and Ligand = 'BDBM190742'   

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 2 (Homo sapiens (Human))	BDBM190742 (US9181236, 42) Show SMILES C[C@]1(CS(=O)(=O)C2(CCCC2)C(=N)N1)c1sc(cc1Cl)-c1cncc(c1)C#N |r| Show InChI InChI=1S/C19H19ClN4O2S2/c1-18(11-28(25,26)19(17(22)24-18)4-2-3-5-19)16-14(20)7-15(27-16)13-6-12(8-21)9-23-10-13/h6-7,9-10H,2-5,11H2,1H3,(H2,22,24)/t18-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	3.40	-49.1	n/a	n/a	n/a	n/a	n/a	5.0	30
Merck Sharp & Dohme Corp. US Patent					Assay Description Inhibitor IC50s at purified human autoBACE-2 are determined in a time-resolved endpoint proteolysis assay that measures hydrolysis of the QSY7-EISE...				US Patent US9181236 (2015) BindingDB Entry DOI: 10.7270/Q2NC5ZZB
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