BDBM50363378 CHEMBL1945729

SMILES: CNc1c(Cl)c(N)c2N(C)C(=O)c3cc(nc1c23)C(N)=O

InChI Key: InChIKey=WMSWELFDEDECGY-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 = 50363378   

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))	BDBM50363378 (CHEMBL1945729) Show SMILES CNc1c(Cl)c(N)c2N(C)C(=O)c3cc(nc1c23)C(N)=O Show InChI InChI=1S/C13H12ClN5O2/c1-17-10-7(14)8(15)11-6-4(13(21)19(11)2)3-5(12(16)20)18-9(6)10/h3,17H,15H2,1-2H3,(H2,16,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.10	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
					More data for this Ligand-Target Pair