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SMILES: COc1cc(ccn1)N1C[C@@H]2CC[C@H](C1)[C@H]2Nc1nc2c(C)ccc(OCC(F)(F)F)n2n1

InChI Key: InChIKey=MOSAKCPQIRMXND-CCWDJLKJSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 476533   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Isoform APP695 of Amyloid-beta precursor protein [K595N,M596L]


(Homo sapiens (Human))		BDBM476533
PNG
(N-((8 endo)-3-(2-methoxypyridin-4-yl)-3-azabicyclo...)
Show SMILES COc1cc(ccn1)N1C[C@@H]2CC[C@H](C1)[C@H]2Nc1nc2c(C)ccc(OCC(F)(F)F)n2n1 |r,TLB:16:15:8.9.14:12.11,THB:4:8:15:12.11|
Show InChI InChI=1S/C22H25F3N6O2/c1-13-3-6-18(33-12-22(23,24)25)31-20(13)28-21(29-31)27-19-14-4-5-15(19)11-30(10-14)16-7-8-26-17(9-16)32-2/h3,6-9,14-15,19H,4-5,10-12H2,1-2H3,(H,27,29)/t14-,15+,19-
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 15.6n/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 US10875854 (2020)


BindingDB Entry DOI: 10.7270/Q28W3HCB
More data for this
Ligand-Target Pair