BDBM14708 Ethyl 3-(biphenyl-3-ylamino)-2-cyanoacrylate::biphenyl compound 13::ethyl (2Z)-2-cyano-3-[(3-phenylphenyl)amino]prop-2-enoate

SMILES CCOC(=O)C(C=Nc1cccc(c1)-c1ccccc1)C#N

InChI Key InChIKey=ADNKWYMTGWSRNK-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 = 14708   

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

LigandPNGBDBM14708(Ethyl 3-(biphenyl-3-ylamino)-2-cyanoacrylate | eth...)
Affinity DataKi:  2.45E+3nM ΔG°:  -7.65kcal/mole IC50: 2.13E+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:
4/2/2007
Entry Details Article
PubMed
LigandPNGBDBM14708(Ethyl 3-(biphenyl-3-ylamino)-2-cyanoacrylate | eth...)
Affinity DataKi:  2.70E+4nM IC50: 2.20E+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 Depth
Date in BDB:
4/2/2007
Entry Details Article
PubMed