Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'E3 ubiquitin-protein ligase Mdm2' and Ligand = 'BDBM50500864'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM50500864 (CHEMBL3798424) Show SMILES COC(=O)c1nn(c(c1NC(=O)c1ccc(OC(C)C)cc1)-c1ccc(OC(C)C)cc1)-c1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C36H35N3O6/c1-23(2)43-29-17-11-25(12-18-29)34-32(37-35(40)26-13-19-30(20-14-26)44-24(3)4)33(36(41)42-5)38-39(34)27-15-21-31(22-16-27)45-28-9-7-6-8-10-28/h6-24H,1-5H3,(H,37,40)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	4.28E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Dalian University of Technology Curated by ChEMBL					Assay Description Displacement of FAM-p53TAD peptide from N-terminal 8x His-tagged human MDM2 (25 to 108 residues) expressed in Escherichia coli BL21 (DE3) after 30 mi...				J Med Chem 59: 3152-62 (2016) Article DOI: 10.1021/acs.jmedchem.5b01913 BindingDB Entry DOI: 10.7270/Q2S75KBK
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