Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Amyloid-beta precursor protein' and Ligand = 'BDBM50210026'   

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))	BDBM50210026 (((2R,5S)-1-(4-chlorophenylsulfonyl)-5-phenylpyrrol...) Show SMILES Clc1ccc(cc1)S(=O)(=O)N1[C@@H](COC(=O)NCCCn2ccnc2)CC[C@H]1c1ccccc1 Show InChI InChI=1S/C24H27ClN4O4S/c25-20-7-10-22(11-8-20)34(31,32)29-21(9-12-23(29)19-5-2-1-3-6-19)17-33-24(30)27-13-4-15-28-16-14-26-18-28/h1-3,5-8,10-11,14,16,18,21,23H,4,9,12-13,15,17H2,(H,27,30)/t21-,23+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	650	n/a	n/a	n/a	n/a	n/a	n/a
Pharmacopeia Drug Discovery, Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase				Bioorg Med Chem Lett 17: 3010-3 (2007) Article DOI: 10.1016/j.bmcl.2007.03.055 BindingDB Entry DOI: 10.7270/Q2QJ7H0H
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