BDBM26213 (3S,6S,9aS)-N-(diphenylmethyl)-6-[(2S)-2-hydroxybutanamido]-5-oxo-octahydro-1H-pyrrolo[1,2-a]azepine-3-carboxamide::bicyclic Smac peptide mimetic, 15

SMILES CC[C@H](O)C(=O)N[C@H]1CCC[C@H]2CC[C@H](N2C1=O)C(=O)NC(c1ccccc1)c1ccccc1

InChI Key InChIKey=HVADKVMBUUALGR-MLCQCVOFSA-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 = 26213   

TargetE3 ubiquitin-protein ligase XIAP [241-356](Homo sapiens (Human))
University Of Michigan

LigandPNGBDBM26213((3S,6S,9aS)-N-(diphenylmethyl)-6-[(2S)-2-hydroxybu...)
Affinity DataKi:  2.90E+4nM ΔG°:  -6.12kcal/molepH: 7.5 T: 2°CAssay Description:Fluorescence polarization was measured on an Ultra plate reader at excitation and emission wavelengths of 485 and 530 nm, respectively. The equilibri...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed