BDBM29038 cyanohydroxybutenamide, 28

SMILES CC(=O)C(C#N)C(=O)Nc1ccc(cc1Cl)-c1ccccc1

InChI Key InChIKey=BMLSPIAZEZWJGN-UHFFFAOYSA-N

Data  2 KI  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 29038   

LigandPNGBDBM29038(cyanohydroxybutenamide, 28)
Affinity DataKi:  39nM IC50: 320nMAssay Description:The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/25/2009
Entry Details Article
PubMed
TargetDihydroorotate dehydrogenase (quinone), mitochondrial(Plasmodium falciparum (isolate 3D7))
University of Leeds

LigandPNGBDBM29038(cyanohydroxybutenamide, 28)
Affinity DataKi:  6.00E+3nM ΔG°:  -7.12kcal/mole IC50: 5.11E+4nMpH: 8.0 T: 2°CAssay Description:The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/25/2009
Entry Details Article
PubMed