BDBM14702 1,3-diethyl 2-[(1H-indazol-5-ylamino)methylidene]propanedioate::2-[(1H-Indazol-5-ylamino)-methylene]-malonic acid diethyl ester::bicyclic compound 7

SMILES CCOC(=O)C(C=Nc1ccc2n[nH]cc2c1)C(=O)OCC

InChI Key InChIKey=SKZMZIKAEKZBBB-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 = 14702   

TargetDihydroorotate dehydrogenase (quinone), mitochondrial(Plasmodium falciparum (isolate 3D7))
University Of Leeds

LigandPNGBDBM14702(1,3-diethyl 2-[(1H-indazol-5-ylamino)methylidene]p...)
Affinity DataKi:  3.20E+3nM ΔG°:  -7.49kcal/mole IC50:  2.78E+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
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetDihydroorotate dehydrogenase (quinone), mitochondrial(Homo sapiens (Human))
University Of Leeds

LigandPNGBDBM14702(1,3-diethyl 2-[(1H-indazol-5-ylamino)methylidene]p...)
Affinity DataKi:  1.51E+4nM IC50:  1.23E+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
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed