Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'E3 ubiquitin-protein ligase UHRF1' and Ligand = 'BDBM50440593'   

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 UHRF1 (Homo sapiens (Human))	BDBM50440593 (CHEMBL2426488) Show SMILES CN(C)C1CCN(CC1)C(=O)c1ccc(cc1)C(=O)N1CCC(CC1)N1CCCC1 Show InChI InChI=1S/C24H36N4O2/c1-25(2)21-9-15-27(16-10-21)23(29)19-5-7-20(8-6-19)24(30)28-17-11-22(12-18-28)26-13-3-4-14-26/h5-8,21-22H,3-4,9-18H2,1-2H3	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina at Chapel Hill Curated by ChEMBL					Assay Description Inhibition of UHRF1 (unknown origin) after 30 mins by AlphaScreen assay				J Med Chem 56: 7358-71 (2013) Article DOI: 10.1021/jm400919p BindingDB Entry DOI: 10.7270/Q2B27WRP
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