BDBM50130830 3-[4-(5-Benzyloxy-indol-1-yl)-butoxycarbonyl]-1-methyl-pyridinium; iodide::CHEMBL111840

SMILES: C[n+]1cccc(c1)C(=O)OCCCCn1ccc2cc(OCc3ccccc3)ccc12

InChI Key: InChIKey=BYSVZUUNCIGWFA-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 = 50130830   

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
NH(3)-dependent NAD(+) synthetase (Bacillus subtilis)	BDBM50130830 (3-[4-(5-Benzyloxy-indol-1-yl)-butoxycarbonyl]-1-me...) Show SMILES C[n+]1cccc(c1)C(=O)OCCCCn1ccc2cc(OCc3ccccc3)ccc12 Show InChI InChI=1S/C26H27N2O3/c1-27-14-7-10-23(19-27)26(29)30-17-6-5-15-28-16-13-22-18-24(11-12-25(22)28)31-20-21-8-3-2-4-9-21/h2-4,7-14,16,18-19H,5-6,15,17,20H2,1H3/q+1	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Alabama at Birmingham Curated by ChEMBL					Assay Description Inhibitory activity against Bacillus subtilis NAD synthetase				J Med Chem 46: 3371-81 (2003) Article DOI: 10.1021/jm030003x BindingDB Entry DOI: 10.7270/Q25T3M6Q
					More data for this Ligand-Target Pair