BDBM44292 MLS-0391027.0001::benzyl (2S)-1-[(2S)-4-methoxy-2-[[(2S)-2-(methylamino)propanoyl]amino]-4-oxobutanoyl]pyrrolidine-2-carboxylate;formic acid::cid_44182154::formic acid;(2S)-1-[(2S)-4-keto-4-methoxy-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]pyrrolidine-2-carboxylic acid benzyl ester::formic acid;(2S)-1-[(2S)-4-methoxy-2-[[(2S)-2-(methylamino)-1-oxopropyl]amino]-1,4-dioxobutyl]-2-pyrrolidinecarboxylic acid (phenylmethyl) ester::methanoic acid;(phenylmethyl) (2S)-1-[(2S)-4-methoxy-2-[[(2S)-2-(methylamino)propanoyl]amino]-4-oxidanylidene-butanoyl]pyrrolidine-2-carboxylate

SMILES CN[C@@H](C)C(=O)N[C@@H](CC(=O)OC)C(=O)N1CCC[C@H]1C(=O)OCc1ccccc1

InChI Key InChIKey=MSCQSVVIEZLHAL-XIRDDKMYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 44292   

TargetE3 ubiquitin-protein ligase XIAP(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM44292(MLS-0391027.0001 | benzyl (2S)-1-[(2S)-4-methoxy-2...)
Affinity DataIC50:  4.40E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetE3 ubiquitin-protein ligase XIAP(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM44292(MLS-0391027.0001 | benzyl (2S)-1-[(2S)-4-methoxy-2...)
Affinity DataIC50:  4.10E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay