BDBM14704 1,3-diethyl 2-{[(2-methylphenyl)amino]methylidene}propanedioate::2-(o-Tolylamino-methylene)-malonic acid diethyl ester::monocyclic compound 9

SMILES CCOC(=O)C(C=Nc1ccccc1C)C(=O)OCC

InChI Key InChIKey=DKJGJYLQPURRFB-UHFFFAOYSA-N

Data  2 KI  2 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 2 hits for monomerid = 14704   

TargetDihydroorotate dehydrogenase (quinone), mitochondrial(Homo sapiens (Human))
University of Leeds

LigandPNGBDBM14704(1,3-diethyl 2-{[(2-methylphenyl)amino]methylidene}...)
Affinity DataKi:  3.59E+4nM IC50:  2.92E+5nMAssay 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 DepthDetails ArticlePubMed
TargetDihydroorotate dehydrogenase (quinone), mitochondrial(Plasmodium falciparum (isolate 3D7))
University of Leeds

LigandPNGBDBM14704(1,3-diethyl 2-{[(2-methylphenyl)amino]methylidene}...)
Affinity DataKi:  3.97E+4nM ΔG°:  -6.00kcal/mole IC50:  3.46E+5nMpH: 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 DepthDetails ArticlePubMed