BDBM50339179 (8S,11S,14S,17S,20S,23S,26S,29S)-26-((1H-imidazol-5-yl)methyl)-20-((1H-indol-3-yl)methyl)-29-((S)-2-((2S,3R)-2-((S)-2-acetamido-4-methylpentanamido)-3-hydroxybutanamido)-3-phenylpropanamido)-8-((S)-1-amino-3-hydroxy-1-oxopropan-2-ylcarbamoyl)-14-(3-amino-3-oxopropyl)-23-(4-hydroxybenzyl)-11-isobutyl-17-methyl-2,10,13,16,19,22,25,28-octaoxo-3,9,12,15,18,21,24,27-octaazadotriacontan-32-oic acid::CHEMBL1689411
SMILES: CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)=O)C(=O)N[C@@H](CO)C(N)=O
InChI Key: InChIKey=IWIUNJXEPOJENS-DTOIXECGSA-N
Data: 1 IC50
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
p53-Binding Protein HDMX (Homo sapiens (Human)) | BDBM50339179 ((8S,11S,14S,17S,20S,23S,26S,29S)-26-((1H-imidazol-...) | PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL KEGG PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 270 | n/a | n/a | n/a | n/a | n/a | n/a |
State University of New York Curated by ChEMBL | Assay Description Inhibition of human GST-tagged MDMX expressed in Escherichia coli harboring integrated p53-Hmd2 protein assessed as blockade of enzyme-p53 interactio... | Bioorg Med Chem Lett 21: 1472-5 (2011) Article DOI: 10.1016/j.bmcl.2011.01.004 BindingDB Entry DOI: 10.7270/Q2M32W33 | |||||||||||
More data for this Ligand-Target Pair |