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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Presenilin-1' and Ligand = 'BDBM50477523'   
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
Presenilin-1


(Homo sapiens (Human))
BDBM50477523
PNG
(CHEMBL246573)
Show SMILES C[C@H](NC(=O)CC1CCCCC1)C(=O)NC1c2ccccc2C=NN(C)C1=O |c:24|
Show InChI InChI=1S/C21H28N4O3/c1-14(23-18(26)12-15-8-4-3-5-9-15)20(27)24-19-17-11-7-6-10-16(17)13-22-25(2)21(19)28/h6-7,10-11,13-15,19H,3-5,8-9,12H2,1-2H3,(H,23,26)(H,24,27)/t14-,19?/m0/s1
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 43n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of gamma secretase assessed as reduction of amyloid beta level in H4 cells


Bioorg Med Chem Lett 17: 4006-11 (2007)


Article DOI: 10.1016/j.bmcl.2007.04.082
BindingDB Entry DOI: 10.7270/Q2XD14GF
More data for this
Ligand-Target Pair