Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Amyloid-beta precursor protein' and Ligand = 'BDBM50499716'   

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))	BDBM50499716 (CHEMBL3741111) Show SMILES [H][C@]12CC=C(C)[C@@]3(Cc4c(O3)c(C)c(C)oc4=O)[C@]1(C)CC[C@]1([H])[C@]2(C)[C@@H](O)CC(=O)OC1(C)C |r,t:3| Show InChI InChI=1S/C27H36O6/c1-14-8-9-19-25(6,27(14)13-17-22(33-27)15(2)16(3)31-23(17)30)11-10-18-24(4,5)32-21(29)12-20(28)26(18,19)7/h8,18-20,28H,9-13H2,1-7H3/t18-,19-,20-,25+,26-,27-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>3.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Korea University Curated by ChEMBL					Assay Description Inhibition of amyloid beta (1 to 42 residues) (unknown origin) aggregation after 24 hrs by thioflavin T assay				J Nat Prod 78: 2572-9 (2015) Article DOI: 10.1021/acs.jnatprod.5b00508 BindingDB Entry DOI: 10.7270/Q29P34NM
					More data for this Ligand-Target Pair
Amyloid-beta precursor protein (Homo sapiens (Human))	BDBM50499716 (CHEMBL3741111) Show SMILES [H][C@]12CC=C(C)[C@@]3(Cc4c(O3)c(C)c(C)oc4=O)[C@]1(C)CC[C@]1([H])[C@]2(C)[C@@H](O)CC(=O)OC1(C)C |r,t:3| Show InChI InChI=1S/C27H36O6/c1-14-8-9-19-25(6,27(14)13-17-22(33-27)15(2)16(3)31-23(17)30)11-10-18-24(4,5)32-21(29)12-20(28)26(18,19)7/h8,18-20,28H,9-13H2,1-7H3/t18-,19-,20-,25+,26-,27-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	>3.00E+5	n/a	n/a	n/a	n/a
Korea University Curated by ChEMBL					Assay Description Inhibition of amyloid beta (25 to 35 residues) (unknown origin) aggregate-induced toxicity in rat PC12 cells preincubated for 1 hr followed by amyloi...				J Nat Prod 78: 2572-9 (2015) Article DOI: 10.1021/acs.jnatprod.5b00508 BindingDB Entry DOI: 10.7270/Q29P34NM
					More data for this Ligand-Target Pair