BDBM50339164 CHEMBL1689396::N-((4S,7S,10S,13S,16S,19S,22S,25S)-16-((1H-imidazol-5-yl)methyl)-22-((1H-indol-3-yl)methyl)-10-benzyl-25-((6S,9S,12S)-1,17-diamino-6-((S)-1-amino-3-hydroxy-1-oxopropan-2-ylcarbamoyl)-1,17-diimino-9-isobutyl-8,11-dioxo-2,7,10,16-tetraazaheptadecan-12-ylcarbamoyl)-19-(4-hydroxybenzyl)-7-((R)-1-hydroxyethyl)-4-isobutyl-13-(4-methacrylamidobutyl)-2,5,8,11,14,17,20,23-octaoxo-3,6,9,12,15,18,21,24-octaazanonacosan-29-yl)-2-(4-methoxyphenyl)-2H-tetrazole-5-carboxamide

SMILES COC1=CC=C(C=C1)N1N=NC(=N1)C(=O)NCCCC[C@H](NC(=O)[C@H](CC1=CNC2=C1C=CC=C2)NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@H](CC1=CN=CN1)NC(=O)[C@H](CCCCNC(=O)C(C)=C)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CO)C(N)=O

InChI Key InChIKey=RNDNPIFFEKEHQE-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 = 50339164   

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

Curated by ChEMBL
LigandPNGBDBM50339164(N-((4S,7S,10S,13S,16S,19S,22S,25S)-16-((1H-imidazo...)
Affinity DataIC50: 160nMAssay 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
LigandPNGBDBM50339164(N-((4S,7S,10S,13S,16S,19S,22S,25S)-16-((1H-imidazo...)
Affinity DataIC50: 390nMAssay 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