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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 = 'BDBM50484499'   
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))
BDBM50484499
PNG
(CHEMBL1926770)
Show SMILES CN(CCF)c1ccc(\C=C/c2nc3ccccc3o2)cc1
Show InChI InChI=1S/C18H17FN2O/c1-21(13-12-19)15-9-6-14(7-10-15)8-11-18-20-16-4-2-3-5-17(16)22-18/h2-11H,12-13H2,1H3/b11-8-
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 167n/an/an/an/an/a



Instituto Tecnol£gico e Nuclear

Curated by ChEMBL


Assay Description
Binding affinity to human amyloid beta (1 to 42) fibril by fluorescence intensity assay


Bioorg Med Chem 19: 7698-710 (2011)


Article DOI: 10.1016/j.bmc.2011.09.065
BindingDB Entry DOI: 10.7270/Q2X63QTN
More data for this
Ligand-Target Pair