BDBM50265901 (S)-3-(3-nitrophenyl)-N-(2-oxotetrahydrofuran-3-yl)propanamide::CHEMBL463121

SMILES: [O-][N+](=O)c1cccc(CCC(=O)N[C@H]2CCOC2=O)c1

InChI Key: InChIKey=PHYWUSQUBAKQHX-NSHDSACASA-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 = 50265901   

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
Transcriptional activator protein luxR (Vibrio fischeri (strain ATCC 700601 / ES114))	BDBM50265901 ((S)-3-(3-nitrophenyl)-N-(2-oxotetrahydrofuran-3-yl...) Show SMILES [O-][N+](=O)c1cccc(CCC(=O)N[C@H]2CCOC2=O)c1 |r| Show InChI InChI=1S/C13H14N2O5/c16-12(14-11-6-7-20-13(11)17)5-4-9-2-1-3-10(8-9)15(18)19/h1-3,8,11H,4-7H2,(H,14,16)/t11-/m0/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	880	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Madison Curated by ChEMBL					Assay Description Antagonist activity at Vibrio fischeri ES114 LuxR receptor assessed as inhibition of OHHL-induced response by luciferase reporter gene assay				Bioorg Med Chem Lett 18: 5978-81 (2008) Article DOI: 10.1016/j.bmcl.2008.07.089 BindingDB Entry DOI: 10.7270/Q2Q81CXX
					More data for this Ligand-Target Pair