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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Presenilin-1' and Ligand = 'BDBM50218981'   
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))		BDBM50218981
PNG
(CHEMBL56177)
Show SMILES CCCCN(C)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC(C)C)NC(=O)Cc1cccc(OC)c1
Show InChI InChI=1S/C29H47N3O4/c1-6-7-16-32(4)29(35)26(19-22-12-9-8-10-13-22)31-28(34)25(17-21(2)3)30-27(33)20-23-14-11-15-24(18-23)36-5/h11,14-15,18,21-22,25-26H,6-10,12-13,16-17,19-20H2,1-5H3,(H,30,33)(H,31,34)/t25-,26-/m0/s1
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PC cid
PC sid
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n/an/a 480n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of gamma-secretase activity in H4 human neuroglioma cells by measuring amyloid beta production

Bioorg Med Chem Lett 14: 1917-21 (2004)


BindingDB Entry DOI: 10.7270/Q2TT4T4K
More data for this
Ligand-Target Pair