BDBM8072 2-anilino-4-(1H-pyrrol-3-yl) pyrimidine deriv. 8c::3,5-dimethyl-4-{2-[(4-methyl-3-nitrophenyl)amino]pyrimidin-4-yl}-1H-pyrrole-2-carbonitrile

SMILES Cc1[nH]c(C#N)c(C)c1-c1ccnc(Nc2ccc(C)c(c2)N(=O)=O)n1

InChI Key InChIKey=VAIKGIPWMFDXHE-UHFFFAOYSA-N

Data  2 KI

  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 = 8072   

LigandPNGBDBM8072(3,5-dimethyl-4-{2-[(4-methyl-3-nitrophenyl)amino]p...)
Affinity DataKi:  50nM ΔG°:  -10.1kcal/molepH: 7.4 T: 2°CAssay Description:In vitro kinase assay using purified enzyme, was incubated at 30 °C with substrate, and test compounds in the presence of 100 uM ATP/ [gamma-32P...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/13/2006
Entry Details Article
PubMed
LigandPNGBDBM8072(3,5-dimethyl-4-{2-[(4-methyl-3-nitrophenyl)amino]p...)
Affinity DataKi:  180nM ΔG°:  -9.35kcal/moleT: 2°CAssay Description:In vitro kinase assay using purified enzyme, was incubated at 30 °C with substrate, and test compounds in the presence of 100 uM ATP/ [gamma-32P...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/13/2006
Entry Details Article
PubMed