Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Gamma-secretase subunit APH-1A/Gamma-secretase subunit APH-1B/Gamma-secretase subunit PEN-2/Nicastrin/Presenilin-1/Presenilin-2' and Ligand = 'BDBM50223755'   

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
Gamma-secretase subunit APH-1A/Gamma-secretase subunit APH-1B/Gamma-secretase subunit PEN-2/Nicastrin/Presenilin-1/Presenilin-2 (Homo sapiens (Human))	BDBM50223755 (CHEMBL118108) Show SMILES COc1cc(CC(=O)N[C@@H](C)C(=O)NC2c3ccccc3C(=O)N(C(C)C)N(C)C2=O)cc(OC)c1 Show InChI InChI=1S/C26H32N4O6/c1-15(2)30-25(33)21-10-8-7-9-20(21)23(26(34)29(30)4)28-24(32)16(3)27-22(31)13-17-11-18(35-5)14-19(12-17)36-6/h7-12,14-16,23H,13H2,1-6H3,(H,27,31)(H,28,32)/t16-,23?/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Tokyo University of Science Curated by ChEMBL					Assay Description Inhibition of human gamma-secretase activity				Bioorg Med Chem Lett 14: 3539-43 (2004) BindingDB Entry DOI: 10.7270/Q20K2BR7
					More data for this Ligand-Target Pair