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SMILES: O=C(NCc1ccc(cc1)S(=O)(=O)C1CCCOC1)N1Cc2ccncc2C1

InChI Key: InChIKey=YADXVYOBJXXUFO-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50439299   

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))	BDBM50439299 (CHEMBL2419521 | US10696692, Example 268) Show SMILES O=C(NCc1ccc(cc1)S(=O)(=O)C1CCCOC1)N1Cc2ccncc2C1 Show InChI InChI=1S/C20H23N3O4S/c24-20(23-12-16-7-8-21-11-17(16)13-23)22-10-15-3-5-18(6-4-15)28(25,26)19-2-1-9-27-14-19/h3-8,11,19H,1-2,9-10,12-14H2,(H,22,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	US Patent	n/a	n/a	17.3	n/a	n/a	n/a	n/a	n/a	n/a
TBA US Patent					Assay Description The NAMPT enzymatic reactions were carried out in Buffer A (50 mM Hepes pH 7.5, 50 mM NaCl, 5 mM MgCl2, and 1 mM THP) in 96-well V-bottom plates. The...				US Patent US10696692 (2020)
					More data for this Ligand-Target Pair
Nicotinamide phosphoribosyltransferase (Homo sapiens (Human))	BDBM50439299 (CHEMBL2419521 | US10696692, Example 268) Show SMILES O=C(NCc1ccc(cc1)S(=O)(=O)C1CCCOC1)N1Cc2ccncc2C1 Show InChI InChI=1S/C20H23N3O4S/c24-20(23-12-16-7-8-21-11-17(16)13-23)22-10-15-3-5-18(6-4-15)28(25,26)19-2-1-9-27-14-19/h3-8,11,19H,1-2,9-10,12-14H2,(H,22,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	44	n/a	n/a	n/a	n/a	n/a	n/a
Genentech Inc Curated by ChEMBL					Assay Description Inhibition of human NAMPT using NAM/PRPP as substrate incubated for 15 mins prior to substrate addition measured after 30 mins by mass spectrometric ...				Bioorg Med Chem Lett 23: 4875-85 (2013) Article DOI: 10.1016/j.bmcl.2013.06.090 BindingDB Entry DOI: 10.7270/Q25T3MWP
					More data for this Ligand-Target Pair