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SMILES: COc1cc(ccc1-n1cnc(C)c1)-c1n[nH]c2N(CCCc12)C(C)c1ccc(F)cc1

InChI Key: InChIKey=WQCGJXHVPJUJEO-UHFFFAOYSA-N

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50483277   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Presenilin-1


(Homo sapiens (Human))		BDBM50483277
PNG
(CHEMBL1643447)
Show SMILES COc1cc(ccc1-n1cnc(C)c1)-c1n[nH]c2N(CCCc12)C(C)c1ccc(F)cc1
Show InChI InChI=1S/C25H26FN5O/c1-16-14-30(15-27-16)22-11-8-19(13-23(22)32-3)24-21-5-4-12-31(25(21)29-28-24)17(2)18-6-9-20(26)10-7-18/h6-11,13-15,17H,4-5,12H2,1-3H3,(H,28,29)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 164n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of gamma secretase-mediated amyloid beta42 production in HEK293 cells by sandwich immunoassay

Bioorg Med Chem Lett 21: 664-9 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.012
BindingDB Entry DOI: 10.7270/Q2930X12
More data for this
Ligand-Target Pair