BDBM50339165 (2S,5S,8S,11S,14S,17S,20S,23S,26S)-17-((1H-indol-3-yl)methyl)-26-((S)-2-((2S,3R)-2-((S)-2-acetamido-4-methylpentanamido)-3-hydroxybutanamido)-3-phenylpropanamido)-1-amino-20-(4-hydroxybenzyl)-5-((R)-1-hydroxyethyl)-2-(hydroxymethyl)-8-isobutyl-23-(4-methacrylamidobutyl)-11-(4-(2-(4-methoxyphenyl)-2H-tetrazole-5-carboxamido)butyl)-14-methyl-1,4,7,10,13,16,19,22,25-nonaoxo-3,6,9,12,15,18,21,24-octaazanonacosan-29-oic acid::CHEMBL1689397

SMILES COc1ccc(cc1)-n1nnc(n1)C(=O)NCCCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCNC(=O)C(C)=C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(N)=O

InChI Key InChIKey=JSVYWKASDGWXNC-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 50339165   

TargetE3 ubiquitin-protein ligase Mdm2(Human)
State University of New York

Curated by ChEMBL
LigandPNGBDBM50339165((2S,5S,8S,11S,14S,17S,20S,23S,26S)-17-((1H-indol-3...)
Affinity DataIC50: 170nMAssay Description:Inhibition of human GST-tagged Mdm2 expressed in Escherichia coli harboring integrated p53-Mmd2 protein assessed as blockade of enzyme-p53 interactio...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/24/2011
Entry Details Article
PubMed
TargetProtein Mdm4(Human)
State University of New York

Curated by ChEMBL
LigandPNGBDBM50339165((2S,5S,8S,11S,14S,17S,20S,23S,26S)-17-((1H-indol-3...)
Affinity DataIC50: 1.60E+3nMAssay Description:Inhibition of human GST-tagged MDMX expressed in Escherichia coli harboring integrated p53-Hmd2 protein assessed as blockade of enzyme-p53 interactio...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/24/2011
Entry Details Article
PubMed