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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Beta amyloid A4 protein' and Ligand = 'BDBM50220290'   
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
Beta amyloid A4 protein


(Homo sapiens (Human))
BDBM50220290
PNG
((2S)-9-(4-chlorophenylsulfonyl)-9-aza-bicyclo[3.3....)
Show SMILES CC(C)(CO)N1CCN(CC1)C(=O)O[C@H]1CCC2CCCC1N2S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C23H34ClN3O5S/c1-23(2,16-28)26-14-12-25(13-15-26)22(29)32-21-11-8-18-4-3-5-20(21)27(18)33(30,31)19-9-6-17(24)7-10-19/h6-7,9-10,18,20-21,28H,3-5,8,11-16H2,1-2H3/t18?,20?,21-/m0/s1
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MMDB

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Similars

Article
PubMed
n/an/a 57n/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Inhibition of gamma-secretase assessed as reduction of membrane Abeta40 level


Bioorg Med Chem Lett 17: 5330-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.08.013
BindingDB Entry DOI: 10.7270/Q21G0KZB
More data for this
Ligand-Target Pair