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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Amyloid-beta precursor protein' and Ligand = 'BDBM50122785'   
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))
BDBM50122785
PNG
(4-(6-bromoH-imidazo[1,2-a]pyridin-2-yl)-N,N-dimeth...)
Show SMILES CN(C)c1ccc(cc1)-c1cn2cc(Br)ccc2n1
Show InChI InChI=1S/C15H14BrN3/c1-18(2)13-6-3-11(4-7-13)14-10-19-9-12(16)5-8-15(19)17-14/h3-10H,1-2H3
PDB
MMDB

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PC cid
PC sid
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Similars

Article
PubMed
5.90n/an/an/an/an/an/an/an/a



National Institute of Mental Health

Curated by ChEMBL


Assay Description
Binding affinity to human beta amyloid plaque in alzheimer's disease patient brain


J Med Chem 50: 4746-58 (2007)


Article DOI: 10.1021/jm0702231
BindingDB Entry DOI: 10.7270/Q2WQ06JK
More data for this
Ligand-Target Pair
Amyloid-beta precursor protein


(Homo sapiens (Human))
BDBM50122785
PNG
(4-(6-bromoH-imidazo[1,2-a]pyridin-2-yl)-N,N-dimeth...)
Show SMILES CN(C)c1ccc(cc1)-c1cn2cc(Br)ccc2n1
Show InChI InChI=1S/C15H14BrN3/c1-18(2)13-6-3-11(4-7-13)14-10-19-9-12(16)5-8-15(19)17-14/h3-10H,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
10.3n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Inhibition constant against [125I]-7 (TZDM) binding to Amyloid beta 1-40 aggregates


J Med Chem 46: 237-43 (2003)


Article DOI: 10.1021/jm020351j
BindingDB Entry DOI: 10.7270/Q2WH2PBC
More data for this
Ligand-Target Pair