BDBM50128966 ((S)-3-Methyl-1-{2-[4-(2-pyrrolidin-1-yl-ethoxy)-phenylamino]-ethylcarbamoyl}-butyl)-carbamic acid benzyl ester::CHEMBL63942

SMILES CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCNc1ccc(OCCN2CCCC2)cc1

InChI Key InChIKey=QYEHSHNAGORASG-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50128966   

TargetCathepsin K(Human)
Novartis Pharma

Curated by ChEMBL
LigandPNGBDBM50128966(((S)-3-Methyl-1-{2-[4-(2-pyrrolidin-1-yl-ethoxy)-p...)
Affinity DataIC50: 1.00E+3nMAssay Description:Inhibitory activity against recombinant human cathepsin K activity using fluorescence assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCathepsin S(Human)
Novartis Pharma

Curated by ChEMBL
LigandPNGBDBM50128966(((S)-3-Methyl-1-{2-[4-(2-pyrrolidin-1-yl-ethoxy)-p...)
Affinity DataIC50: 9.50E+3nMAssay Description:Inhibitory activity against recombinant human cathepsin S activityMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetProcathepsin L(Human)
Novartis Pharma

Curated by ChEMBL
LigandPNGBDBM50128966(((S)-3-Methyl-1-{2-[4-(2-pyrrolidin-1-yl-ethoxy)-p...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibitory activity against recombinant human cathepsin L activityMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed