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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Protein Mdm4' and Ligand = 'BDBM50506488'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Protein Mdm4


(Homo sapiens (Human))		BDBM50506488
PNG
(CHEMBL4474794)
Show SMILES CC(C)C[C@@H](CN(CC(=O)N[C@H](CN(CC(=O)N[C@@H](CCC(O)=O)CN1CC(=O)N[C@@H](Cc2c[nH]c3ccccc23)CN(CC(=O)N[C@@H](CCCCN)CN(CC(=O)N[C@@H](CC(C)C)CN(CC(=O)N[C@@H](C)CN(CC(N)=O)S(C)(=O)=O)S(=O)(=O)CC(C)C)S(=O)(=O)CC\C=C\CCCCS1(=O)=O)S(C)(=O)=O)S(C)(=O)=O)Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)NC(C)=O |r,t:96|
Show InChI InChI=1S/C83H134ClN17O24S7/c1-59(2)39-69(89-63(8)102)50-101(132(124,125)73-33-30-66(84)31-34-73)57-82(109)93-71(41-64-25-17-16-18-26-64)47-96(127(10,114)115)53-79(106)91-68(32-35-83(110)111)46-99-56-81(108)94-72(42-65-43-87-75-29-20-19-28-74(65)75)48-97(128(11,116)117)52-78(105)90-67(27-21-22-36-85)45-98(129(118,119)37-23-14-12-13-15-24-38-130(99,120)121)55-80(107)92-70(40-60(3)4)49-100(131(122,123)58-61(5)6)54-77(104)88-62(7)44-95(51-76(86)103)126(9,112)113/h12,14,16-20,25-26,28-31,33-34,43,59-62,67-72,87H,13,15,21-24,27,32,35-42,44-58,85H2,1-11H3,(H2,86,103)(H,88,104)(H,89,102)(H,90,105)(H,91,106)(H,92,107)(H,93,109)(H,94,108)(H,110,111)/b14-12+/t62-,67-,68-,69-,70-,71-,72-/m0/s1
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6.60E+3n/an/an/an/an/an/a



University of South Florida

Curated by ChEMBL


Assay Description
Binding affinity to MDMX (unknown origin) by using (FITC)-labeled p53 peptide based fluorescence polarization competitive assay

J Med Chem 63: 975-986 (2020)


Article DOI: 10.1021/acs.jmedchem.9b00993
BindingDB Entry DOI: 10.7270/Q2D79FPH
More data for this
Ligand-Target Pair