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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Presenilin-1' and Ligand = 'BDBM50481570'   
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))		BDBM50481570
PNG
(CHEMBL589505)
Show SMILES COc1ccc(cc1)N1CCN(CC1(C)C)c1nc(Nc2cc(ccc2C)C(C)(C)C)cc(n1)C(=O)NCC1CCCO1
Show InChI InChI=1S/C34H46N6O3/c1-23-10-11-24(33(2,3)4)19-28(23)36-30-20-29(31(41)35-21-27-9-8-18-43-27)37-32(38-30)39-16-17-40(34(5,6)22-39)25-12-14-26(42-7)15-13-25/h10-15,19-20,27H,8-9,16-18,21-22H2,1-7H3,(H,35,41)(H,36,37,38)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of gamma-secretase-mediated NotchdeltaE cleavage in human HeLa cells by luciferase assay

Bioorg Med Chem Lett 20: 1269-71 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.101
BindingDB Entry DOI: 10.7270/Q2H9981J
More data for this
Ligand-Target Pair