BDBM22130 aza-peptide Michael acceptor, 5n::benzyl N-[(1S)-1-{[(2S)-1-[(2E)-N-benzyl-3-[N-(carbamoylmethyl)hydrazido]-N-[(4-methoxyphenyl)methyl]prop-2-enamide]-1-oxopropan-2-yl]carbamoyl}ethyl]carbamate

SMILES COc1ccc(CN(Cc2ccccc2)C(=O)C=CC(=O)N(CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1

InChI Key InChIKey=WXQYPIFVHAYZGN-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 22130   

TargetLegumain(Blood fluke)
Georgia Institute of Technology

LigandPNGBDBM22130(benzyl N-[(1S)-1-{[(2S)-1-[(2E)-N-benzyl-3-[N-(car...)
Affinity DataIC50: 90nMpH: 6.8 T: 2°CAssay Description:AE activity in the induction medium was measured with the substrate Cbz-Ala-Ala-Asn-AMC. In a black 96-well microtiter plate, aza-peptidyl inhibitors...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/9/2008
Entry Details Article
PubMed
TargetClan CD, family C13, asparaginyl endopeptidase-like cysteine peptidase(Trichomonas vaginalis G3)
Georgia Institute of Technology

LigandPNGBDBM22130(benzyl N-[(1S)-1-{[(2S)-1-[(2E)-N-benzyl-3-[N-(car...)
Affinity DataIC50: 2.30nMT: 2°CAssay Description:AE activity in the induction medium was measured with the substrate Cbz-Ala-Ala-Asn-AMC. In a black 96-well microtiter plate, aza-peptidyl inhibitors...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/9/2008
Entry Details Article
PubMed
TargetLegumain(Common tick)
Georgia Institute of Technology

LigandPNGBDBM22130(benzyl N-[(1S)-1-{[(2S)-1-[(2E)-N-benzyl-3-[N-(car...)
Affinity DataIC50: 12nMT: 2°CAssay Description:AE activity in the induction medium was measured with the substrate Cbz-Ala-Ala-Asn-AMC. In a black 96-well microtiter plate, aza-peptidyl inhibitors...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/9/2008
Entry Details Article
PubMed