null

SMILES: O[C@H]1[C@H](O)[C@H](O[C@@H]1CNC1CCCCCC1)C(=O)Nc1cccc(c1)[N+]([O-])=O

InChI Key: InChIKey=ILBLKZHRKKHEBC-BDXSIMOUSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50270448   

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
Pyruvate kinase (Leishmania mexicana)	BDBM50270448 ((2S,3S,4S,5R)-5-((cycloheptylamino)methyl)-3,4-dih...) Show SMILES O[C@H]1[C@H](O)[C@H](O[C@@H]1CNC1CCCCCC1)C(=O)Nc1cccc(c1)[N+]([O-])=O |r| Show InChI InChI=1S/C19H27N3O6/c23-16-15(11-20-12-6-3-1-2-4-7-12)28-18(17(16)24)19(25)21-13-8-5-9-14(10-13)22(26)27/h5,8-10,12,15-18,20,23-24H,1-4,6-7,11H2,(H,21,25)/t15-,16-,17+,18+/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Edinburgh Curated by ChEMBL					Assay Description Inhibition of Leishmania mexicana pyruvate kinase				Bioorg Med Chem 16: 5050-61 (2008) Article DOI: 10.1016/j.bmc.2008.03.045 BindingDB Entry DOI: 10.7270/Q21J99JR
					More data for this Ligand-Target Pair