BDBM25381 1,7-dibenzyl-8-[(2-hydroxyethyl)sulfanyl]-3-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione::purine-2,6-dione, 24

SMILES Cn1c2nc(SCCO)n(Cc3ccccc3)c2c(=O)n(Cc2ccccc2)c1=O

InChI Key InChIKey=VTFCZAWGUWVLNZ-UHFFFAOYSA-N

Data  1 KI  1 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 1 hit for monomerid = 25381   

TargetSerine/threonine-protein kinase B-raf(Homo sapiens (Human))
University Of Pennsylvania

LigandPNGBDBM25381(1,7-dibenzyl-8-[(2-hydroxyethyl)sulfanyl]-3-methyl...)
Affinity DataKi:  106nM ΔG°:  -9.89kcal/mole IC50:  1.72E+3nMpH: 7.0 T: 2°CAssay Description:BRAF kinase activity was quantified using an ELISA-based MEK phosphorylation assay. IC50 values were derived from the sigmoidal dose-response curve f...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed