BDBM19882 N-(cyanomethyl)-4-methyl-2-{3-[2-(piperazin-1-yl)phenyl]phenyl}pentanamide::Nonpeptidic Biaryl Nitrile Compound, 44

SMILES CC(C)CC(C(=O)NCC#N)c1cccc(c1)-c1ccccc1N1CCNCC1

InChI Key InChIKey=ABTLMVRXRICKRX-UHFFFAOYSA-N

Data  4 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 4 hits for monomerid = 19882   

TargetCathepsin K(Homo sapiens (Human))
Merck Frosst Centre For Therapeutic Research

LigandPNGBDBM19882(N-(cyanomethyl)-4-methyl-2-{3-[2-(piperazin-1-yl)p...)
Affinity DataIC50:  58nMpH: 5.5 T: 2°CAssay Description:Prior to the addition of substrate, different concentrations of the inhibitor ranging from 100 uM to 0.2 nM were preincubated for 15 min with enzyme ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCathepsin B(Homo sapiens (Human))
Merck Frosst Centre For Therapeutic Research

LigandPNGBDBM19882(N-(cyanomethyl)-4-methyl-2-{3-[2-(piperazin-1-yl)p...)
Affinity DataIC50:  1.25E+3nMAssay Description:Prior to the addition of substrate, different concentrations of the inhibitor ranging from 100 uM to 0.2 nM were preincubated for 15 min with enzyme ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCathepsin S(Homo sapiens (Human))
Merck Frosst Centre For Therapeutic Research

LigandPNGBDBM19882(N-(cyanomethyl)-4-methyl-2-{3-[2-(piperazin-1-yl)p...)
Affinity DataIC50:  521nMAssay Description:Prior to the addition of substrate, different concentrations of the inhibitor ranging from 100 uM to 0.2 nM were preincubated for 15 min with enzyme ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProcathepsin L(Homo sapiens (Human))
Merck Frosst Centre For Therapeutic Research

LigandPNGBDBM19882(N-(cyanomethyl)-4-methyl-2-{3-[2-(piperazin-1-yl)p...)
Affinity DataIC50:  338nMAssay Description:Prior to the addition of substrate, different concentrations of the inhibitor ranging from 100 uM to 0.2 nM were preincubated for 15 min with enzyme ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed