BDBM27075 (1R,2S,5S)-N-[(1R)-1-(dihydroxyboranyl)propyl]-3-[(2S)-2-({[(2S)-1-[methane(methyl)sulfonamido]-3,3-dimethylbutan-2-yl]carbamoyl}amino)-3,3-dimethylbutanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide::boronic acid derivative, 16

SMILES CC[C@H](NC(=O)[C@@H]1[C@@H]2[C@H](CN1C(=O)[C@@H](NC(=O)N[C@H](CN(C)S(C)(=O)=O)C(C)(C)C)C(C)(C)C)C2(C)C)B(O)O

InChI Key InChIKey=UMYAKNFHFKBYJZ-UHFFFAOYSA-N

Data  1 KI

  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 1 hit for monomerid = 27075   

TargetGenome polyprotein(HCV)
Schering-Plough Research Institute

LigandPNGBDBM27075((1R,2S,5S)-N-[(1R)-1-(dihydroxyboranyl)propyl]-3-[...)
Affinity DataKi:  52nM ΔG°:  -10.1kcal/molepH: 6.5 T: 2°CAssay Description:Proteolytic cleavage of the ester linkage between the Nva (L-norvaline) and the chromophore (PAP) was monitored for change in absorbance at 370 nm. I...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/20/2009
Entry Details Article
PubMed