BDBM86094 2-Cyanopyrrolidine Derivative, 23

SMILES COc1ccc(\C=C\C(=O)NC(CC(C)C)C(=O)N2CCC[C@H]2C#N)cc1

InChI Key InChIKey=SDEBVHUVRONJEX-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 86094   

TargetCathepsin B(Human)
The M. S. University of Baroda

LigandPNGBDBM86094(2-Cyanopyrrolidine Derivative, 23)
Affinity DataKi:  6.70E+4nM ΔG°:  -5.65kcal/molepH: 6.0 T: 2°CAssay Description:The fluorescence for the assay was monitored on a Varian Gemini spectrofluorometer with the excitation and emission wavelengths at 380 and 440nm. Th...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/21/2012
Entry Details Article
PubMed
TargetCathepsin B(Human)
The M. S. University of Baroda

LigandPNGBDBM86094(2-Cyanopyrrolidine Derivative, 23)
Affinity DataKi:  9.20E+4nM ΔG°:  -5.47kcal/molepH: 6.0 T: 2°CAssay Description:The fluorescence for the assay was monitored on a Varian Gemini spectrofluorometer with the excitation and emission wavelengths at 380 and 440nm. Th...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/21/2012
Entry Details Article
PubMed