BDBM19828 (1R,2R)-2-{[(3-chlorophenyl)sulfanyl]methyl}-N-(cyanomethyl)cyclohexane-1-carboxamide::Cyclohexanecarboxamide derivative, 12l::racemic mixture

SMILES Clc1cccc(SC[C@@H]2CCCC[C@H]2C(=O)NCC#N)c1

InChI Key InChIKey=TYFZAFFOCPEUIC-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 19828   

TargetCathepsin K(Rabbit)
Merck Frosst Centre For Therapeutic Research

LigandPNGBDBM19828(racemic mixture | (1R,2R)-2-{[(3-chlorophenyl)sulf...)
Affinity DataIC50: 200nMpH: 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 Depth
Date in BDB:
1/4/2008
Entry Details Article
PubMed
TargetProcathepsin L(Human)
Rheinische Friedrich-Wilhelms-Universit£T

Curated by ChEMBL
LigandPNGBDBM19828(racemic mixture | (1R,2R)-2-{[(3-chlorophenyl)sulf...)
Affinity DataIC50: 3.60E+3nMAssay Description:Inhibition of cathepsin LMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/7/2013
Entry Details Article
PubMed
TargetCathepsin B(Human)
Rheinische Friedrich-Wilhelms-Universit£T

Curated by ChEMBL
LigandPNGBDBM19828(racemic mixture | (1R,2R)-2-{[(3-chlorophenyl)sulf...)
Affinity DataIC50: 1.02E+5nMAssay Description:Inhibition of cathepsin BMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/7/2013
Entry Details Article
PubMed