BDBM33975 arylalkyne pyrazole-based compound, 6

SMILES CC(C)CC#Cc1cc(ccc1Cl)-c1nn(CCCN2CCOCC2)c2CCN(Cc12)S(C)(=O)=O

InChI Key InChIKey=VMEVYWVDVRVQJT-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 33975   

TargetCathepsin S(Human)
Johnson & Johnson Pharmaceutical

LigandPNGBDBM33975(arylalkyne pyrazole-based compound, 6)
Affinity DataIC50: 8.30E+3nMpH: 5.0 T: 2°CAssay Description:Enzyme assays were run using fluorescence resonance energy transfer-based substrates, (Aedens)EKARVLAEAA(Dabcyl)K-amide and cathepsin S cleaves betwe...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/8/2009
Entry Details Article
PubMed