BDBM50347423 CHEMBL1801938

SMILES: Cc1nc2ccc(CN(CC#C)c3ccc(cc3)C(=O)NCc3nc4ccccc4[nH]3)cc2c(=O)n1C

InChI Key: InChIKey=RTXIYUXAMFFHRD-UHFFFAOYSA-N

Data: 1 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50347423   

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
Nicotinamide phosphoribosyltransferase (Homo sapiens (Human))	BDBM50347423 (CHEMBL1801938) Show SMILES Cc1nc2ccc(CN(CC#C)c3ccc(cc3)C(=O)NCc3nc4ccccc4[nH]3)cc2c(=O)n1C Show InChI InChI=1S/C29H26N6O2/c1-4-15-35(18-20-9-14-24-23(16-20)29(37)34(3)19(2)31-24)22-12-10-21(11-13-22)28(36)30-17-27-32-25-7-5-6-8-26(25)33-27/h1,5-14,16H,15,17-18H2,2-3H3,(H,30,36)(H,32,33)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
Myrexis, Inc. Curated by ChEMBL					Assay Description Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide				J Med Chem 53: 8734-46 (2010) Article DOI: 10.1021/jm101145b BindingDB Entry DOI: 10.7270/Q26H4HSP
					More data for this Ligand-Target Pair