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BDBM50491255 CHEMBL2381386

SMILES: COc1ccc2cc(C(=O)CN3CCC(Cc4ccccc4)CC3)c(=O)oc2c1

InChI Key: InChIKey=QGVJOWMACGPXFH-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50491255   
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
Beta amyloid A4 protein


(Homo sapiens (Human))
BDBM50491255
PNG
(CHEMBL2381386)
Show SMILES COc1ccc2cc(C(=O)CN3CCC(Cc4ccccc4)CC3)c(=O)oc2c1
Show InChI InChI=1S/C24H25NO4/c1-28-20-8-7-19-14-21(24(27)29-23(19)15-20)22(26)16-25-11-9-18(10-12-25)13-17-5-3-2-4-6-17/h2-8,14-15,18H,9-13,16H2,1H3
PDB
MMDB

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DrugBank
antibodypedia
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.60E+4n/an/an/an/an/an/a



University of Massachusetts Boston

Curated by ChEMBL


Assay Description
Inhibition of amyloid beta ((1 to 42) (unknown origin) oligomer assembly after 30 mins by biotinyl-streptavidin assay


Bioorg Med Chem Lett 23: 2614-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.02.103
BindingDB Entry DOI: 10.7270/Q27M0BWS
More data for this
Ligand-Target Pair