Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Amyloid-beta precursor protein' and Ligand = 'BDBM145841'   

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
Amyloid-beta precursor protein (Homo sapiens (Human))	BDBM145841 (US8956589, 1) Show SMILES COC(=O)CCC(C(=O)\C=C\c1ccc(O)c(OC(F)(F)F)c1)C(=O)\C=C\c1ccc(O)c(OC(F)(F)F)c1 Show InChI InChI=1S/C25H20F6O8/c1-37-23(36)11-6-16(17(32)7-2-14-4-9-19(34)21(12-14)38-24(26,27)28)18(33)8-3-15-5-10-20(35)22(13-15)39-25(29,30)31/h2-5,7-10,12-13,16,34-35H,6,11H2,1H3/b7-2+,8-3+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	440	n/a	n/a	n/a	n/a	7.5	30
Shiga University of Medical Science US Patent					Assay Description First, amyloid beta peptides (1-40, Peptide Institute, Minoh-shi, Osaka) were dissolved in a 50 mM phosphate buffer containing 100 mM sodium chloride...				US Patent US8956589 (2015) BindingDB Entry DOI: 10.7270/Q2BG2MQ5
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