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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 = 'BDBM50477440'   
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))
BDBM50477440
PNG
(CHEMBL245478)
Show SMILES CN(C)c1ccc(\C=C\c2cc(Br)cc(\C=C\c3ccc(cc3)N(C)C)c2)cc1
Show InChI InChI=1S/C26H27BrN2/c1-28(2)25-13-9-20(10-14-25)5-7-22-17-23(19-24(27)18-22)8-6-21-11-15-26(16-12-21)29(3)4/h5-19H,1-4H3/b7-5+,8-6+
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



Korea Institute of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of amyloid beta 42 fibril formation by thioflavin T assay


Bioorg Med Chem Lett 17: 1466-70 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.090
BindingDB Entry DOI: 10.7270/Q2PV6P4S
More data for this
Ligand-Target Pair