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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Amyloid-beta precursor protein' and Ligand = 'BDBM455344'   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Amyloid-beta precursor protein


(Homo sapiens (Human))		BDBM455344
PNG
(7-(4-Fluorophenyl)-N4-methyl-N2-((1R,5S,8s)-3-(6-m...)
Show SMILES Cc1cc(ncn1)N1CC2CCC(C1)C2Nc1nc2N(CCc2c(Cl)n1)c1ccc(F)cc1 |TLB:15:14:10.11:8.13.7,THB:3:7:14:10.11|
Show InChI InChI=1S/C24H25ClFN7/c1-14-10-20(28-13-27-14)32-11-15-2-3-16(12-32)21(15)29-24-30-22(25)19-8-9-33(23(19)31-24)18-6-4-17(26)5-7-18/h4-7,10,13,15-16,21H,2-3,8-9,11-12H2,1H3,(H,29,30,31)
PDB
MMDB

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US Patent
n/an/an/an/a 12n/an/an/an/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 US10730881 (2020)


BindingDB Entry DOI: 10.7270/Q27M0C0J
More data for this
Ligand-Target Pair