null

SMILES: COc1cc(Nc2nc3c(ccc(O[C@@H](C)C(F)(F)F)n3n2)C(C)(C)O)ccc1-n1cnc(C)n1

InChI Key: InChIKey=XTRVRSOEXQUNDQ-LBPRGKRZSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 476551   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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 (PreA4 695) 595N,M596L] (Homo sapiens (Human))	BDBM476551 (US10875854, Example 24 | US10875854, Example 33) Show SMILES COc1cc(Nc2nc3c(ccc(O[C@@H](C)C(F)(F)F)n3n2)C(C)(C)O)ccc1-n1cnc(C)n1 |r| Show InChI InChI=1S/C22H24F3N7O3/c1-12(22(23,24)25)35-18-9-7-15(21(3,4)33)19-28-20(30-32(18)19)27-14-6-8-16(17(10-14)34-5)31-11-26-13(2)29-31/h6-12,33H,1-5H3,(H,27,30)/t12-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	39	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)
					More data for this Ligand-Target Pair
Isoform APP695 of Amyloid-beta precursor protein (PreA4 695) 595N,M596L] (Homo sapiens (Human))	BDBM476551 (US10875854, Example 24 | US10875854, Example 33) Show SMILES COc1cc(Nc2nc3c(ccc(O[C@@H](C)C(F)(F)F)n3n2)C(C)(C)O)ccc1-n1cnc(C)n1 |r| Show InChI InChI=1S/C22H24F3N7O3/c1-12(22(23,24)25)35-18-9-7-15(21(3,4)33)19-28-20(30-32(18)19)27-14-6-8-16(17(10-14)34-5)31-11-26-13(2)29-31/h6-12,33H,1-5H3,(H,27,30)/t12-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	39	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)
					More data for this Ligand-Target Pair