BDBM50354530 CHEMBL340884

SMILES: COc1ccc2c(c1)c(=O)c1c(NCCN(C)C)ccc3nc(C)n2c13

InChI Key: InChIKey=MTLXDBXSTFPBGA-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50354530   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50354530 (CHEMBL340884) Show SMILES COc1ccc2c(c1)c(=O)c1c(NCCN(C)C)ccc3nc(C)n2c13 Show InChI InChI=1S/C20H22N4O2/c1-12-22-16-7-6-15(21-9-10-23(2)3)18-19(16)24(12)17-8-5-13(26-4)11-14(17)20(18)25/h5-8,11,21H,9-10H2,1-4H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	46	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2 assessed as reduction of DCPIP by spectrophotometry				J Med Chem 54: 6597-611 (2011) Article DOI: 10.1021/jm200416e BindingDB Entry DOI: 10.7270/Q21Z44TH
					More data for this Ligand-Target Pair