Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Ribosyldihydronicotinamide dehydrogenase [quinone]' and Ligand = 'BDBM50515993'   

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
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50515993 (CHEMBL4527344) Show SMILES COc1ccc2nc(C)cc(NNC(=O)c3ccccc3)c2c1 Show InChI InChI=1S/C18H17N3O2/c1-12-10-17(15-11-14(23-2)8-9-16(15)19-12)20-21-18(22)13-6-4-3-5-7-13/h3-11H,1-2H3,(H,19,20)(H,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	472	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO2 expressed in Escherichia coli using DCPIP as substrate by spectrophotometry				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
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