BDBM50274105 CHEMBL455292::N-[(1S,2S)-3-Cyclopropylcarbamoyl-1-(3,5-difluorophenoxymethyl)-2-hydroxy-propyl]-5-(methanesulfonylmethyl-amino)-N0-((R)-1-phenyl-ethyl)-isophthalamide

SMILES C[C@@H](NC(=O)c1cc(cc(c1)C(=O)N[C@@H](COc1cc(F)cc(F)c1)[C@@H](O)CC(=O)NC1CC1)N(C)S(C)(=O)=O)c1ccccc1

InChI Key InChIKey=ZSJNKDSKAWTNOG-UHFFFAOYSA-N

Data  1 KI  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50274105   

TargetCathepsin D(Human)
LinköPing University

Curated by ChEMBL
LigandPNGBDBM50274105(N-[(1S,2S)-3-Cyclopropylcarbamoyl-1-(3,5-difluorop...)
Affinity DataKi: >5.00E+3nMAssay Description:Inhibition of human cathepsin DMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetBeta-secretase 1(Human)
LinköPing University

Curated by ChEMBL
LigandPNGBDBM50274105(N-[(1S,2S)-3-Cyclopropylcarbamoyl-1-(3,5-difluorop...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of human BACE1 expressed in Escherichia coli BL21(DE3) by resolved fluorescence assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed