Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Ribosyldihydronicotinamide dehydrogenase [quinone]' and Ligand = 'BDBM50363370'   

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))	BDBM50363370 (CHEMBL1945624) Show SMILES NC(=O)c1cc(C(N)=O)c2cc(I)c(N)cc2n1 Show InChI InChI=1S/C11H9IN4O2/c12-6-1-4-5(10(14)17)2-9(11(15)18)16-8(4)3-7(6)13/h1-3H,13H2,(H2,14,17)(H2,15,18)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of human quinone reductase 2 using NMeH as substrate by MTT assay				J Med Chem 55: 367-77 (2012) Article DOI: 10.1021/jm201251c BindingDB Entry DOI: 10.7270/Q228083N
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