Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'E3 ubiquitin-protein ligase Mdm2' and Ligand = 'BDBM152991'   

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))	BDBM152991 (US8993614, 11B) Show SMILES COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)O[C@H](C)OC(=O)N1CCOCC1 |r| Show InChI InChI=1S/C38H40Cl2F2N4O7/c1-21(53-36(49)46-13-15-51-16-14-46)52-35(48)22-9-12-28(29(17-22)50-5)44-34(47)33-31(24-7-6-8-26(40)32(24)42)38(20-43,30(45-33)19-37(2,3)4)25-11-10-23(39)18-27(25)41/h6-12,17-18,21,30-31,33,45H,13-16,19H2,1-5H3,(H,44,47)/t21-,30-,31-,33+,38-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	19.4	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche AG US Patent					Assay Description The ability of the compounds to inhibit the interaction between p53 and MDM2 proteins was measured by an HTRF (homogeneous time-resolved fluorescence...				US Patent US8993614 (2015) BindingDB Entry DOI: 10.7270/Q27W69XV
					More data for this Ligand-Target Pair