Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Isoform APP695 of Amyloid-beta precursor protein [K595N,M596L]' and Ligand = 'BDBM476546'   

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
Isoform APP695 of Amyloid-beta precursor protein [K595N,M596L] (Homo sapiens (Human))	BDBM476546 (3-Methoxy-4-(3-methyl-1,2,4-triazol-1-yl)aniline |...) Show SMILES COc1cc(Nc2nc3c(ccc(OCC(F)(F)F)n3n2)C(C)C)ccc1-n1cnc(C)n1 Show InChI InChI=1S/C21H22F3N7O2/c1-12(2)15-6-8-18(33-10-21(22,23)24)31-19(15)27-20(29-31)26-14-5-7-16(17(9-14)32-4)30-11-25-13(3)28-30/h5-9,11-12H,10H2,1-4H3,(H,26,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	26.6	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Human neuroglioma H4 cells overexpressing human APP695 with the Swedish double mutation (K595N/M596L) were plated at 30,000 cells/well/100 μl in...				US Patent US10875854 (2020) BindingDB Entry DOI: 10.7270/Q28W3HCB
					More data for this Ligand-Target Pair