Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'E3 ubiquitin-protein ligase Mdm2' and Ligand = 'BDBM50234697'   

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))	BDBM50234697 (CHEMBL4071258) Show SMILES CCCCCNC(c1nnnn1Cc1ccc(OCc2ccccc2Cl)cc1)c1c([nH]c2cc(Cl)ccc12)C(O)=O Show InChI InChI=1S/C30H30Cl2N6O3/c1-2-3-6-15-33-27(26-23-14-11-21(31)16-25(23)34-28(26)30(39)40)29-35-36-37-38(29)17-19-9-12-22(13-10-19)41-18-20-7-4-5-8-24(20)32/h4-5,7-14,16,27,33-34H,2-3,6,15,17-18H2,1H3,(H,39,40)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Curated by ChEMBL					Assay Description Inhibition of 5'--FAM-LTFEHYWAQLTS peptide binding to N-terminal domain human MDM2 (1 to 118 residues) expressed in Escherichia coli BL21(DE3) measur...				Eur J Med Chem 126: 384-407 (2017) Article DOI: 10.1016/j.ejmech.2016.11.029 BindingDB Entry DOI: 10.7270/Q2JQ1381
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