BDBM13159 3-ethyl-2,5-dihydroxycyclohexa-2,5-diene-1,4-dione::Embelin deriv. 6a

SMILES Oc1cc(O)c(O)c(C=C)c1O

InChI Key InChIKey=HPINTYLIRRVITJ-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 13159   

TargetE3 ubiquitin-protein ligase XIAP [241-356](Human)
University of Michigan

LigandPNGBDBM13159(3-ethyl-2,5-dihydroxycyclohexa-2,5-diene-1,4-dione...)
Affinity DataKi:  1.04E+4nM ΔG°:  -6.72kcal/molepH: 7.5 T: 2°CAssay Description:A quantitative in vitro binding assay using the fluorescence polarization (FP) based method was developed and used to determine the binding affinity ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/15/2007
Entry Details Article
PubMed