BDBM20094 dipeptide-derived nitrile, 15::tert-butyl N-[(S)-[(cyanomethyl)carbamoyl](phenyl)methyl]carbamate

SMILES CC(C)(C)OC(=O)N[C@H](C(=O)NCC#N)c1ccccc1

InChI Key InChIKey=WPVXVVULHKNUFP-LBPRGKRZSA-N

Data  5 KI

  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 5 hits for monomerid = 20094   

TargetCathepsin B(Human)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM20094(dipeptide-derived nitrile, 15 | tert-butyl N-[(S)-...)
Affinity DataKi: >330nMpH: 6.0Assay Description:Inhibition of human liver cathepsin B using Cbz-Arg-Arg-pNA as substrate at pH 6 incubated for 30 mins measured for 20 mins by photometrical analysisMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetCathepsin S(Human)
Rheinische Friedrich-Wilhelms-Universitat Bonn

LigandPNGBDBM20094(dipeptide-derived nitrile, 15 | tert-butyl N-[(S)-...)
Affinity DataKi:  1.70E+3nMAssay Description:Enzyme activities were calculated from kinetic measurements performed by fluorimetric detection of the product AMC at the wavelengths for excitation ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetProcathepsin L(Bovine)
Rheinische Friedrich-Wilhelms-Universitat Bonn

LigandPNGBDBM20094(dipeptide-derived nitrile, 15 | tert-butyl N-[(S)-...)
Affinity DataKi:  2.90E+4nMAssay Description:Enzyme activities were calculated from kinetic measurements performed by fluorimetric detection of the product AMC at the wavelengths for excitation ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetPapain(Papaya)
Rheinische Friedrich-Wilhelms-Universitat Bonn

LigandPNGBDBM20094(dipeptide-derived nitrile, 15 | tert-butyl N-[(S)-...)
Affinity DataKi:  8.30E+4nM ΔG°:  -5.56kcal/molepH: 6.5 T: 25°CAssay Description:Enzyme activities were calculated from kinetic measurements performed by spectrophotometric detection of the product p-nitroaniline (pNA) at waveleng...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetCathepsin K(Human)
Rheinische Friedrich-Wilhelms-Universitat Bonn

LigandPNGBDBM20094(dipeptide-derived nitrile, 15 | tert-butyl N-[(S)-...)
Affinity DataKi:  9.00E+4nMAssay Description:Enzyme activities were calculated from kinetic measurements performed by fluorimetric detection of the product AMC at the wavelengths for excitation ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed