BDBM50293447 CHEMBL549935::N,N-diethyl-N-methyl-3-(7-oxo-7H-dibenzo[de,g]quinoline-4-carboxamido)propan-1-aminium iodide

SMILES: CC[N+](C)(CC)CCCNC(=O)c1cnc2C(=O)c3ccccc3-c3cccc1c23

InChI Key: InChIKey=PMGNTUDELMPHHT-UHFFFAOYSA-O

Data: 2 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 2 hits for monomerid = 50293447   

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
Butyrylcholinesterase (BuChE) (Equus caballus (Horse))	BDBM50293447 (CHEMBL549935 | N,N-diethyl-N-methyl-3-(7-oxo-7H-di...) Show SMILES CC[N+](C)(CC)CCCNC(=O)c1cnc2C(=O)c3ccccc3-c3cccc1c23 Show InChI InChI=1S/C25H27N3O2/c1-4-28(3,5-2)15-9-14-26-25(30)21-16-27-23-22-18(12-8-13-19(21)22)17-10-6-7-11-20(17)24(23)29/h6-8,10-13,16H,4-5,9,14-15H2,1-3H3/p+1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.72E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE by Ellman's method				Eur J Med Chem 44: 2523-32 (2009) Article DOI: 10.1016/j.ejmech.2009.01.021 BindingDB Entry DOI: 10.7270/Q2Z89CFV
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50293447 (CHEMBL549935 | N,N-diethyl-N-methyl-3-(7-oxo-7H-di...) Show SMILES CC[N+](C)(CC)CCCNC(=O)c1cnc2C(=O)c3ccccc3-c3cccc1c23 Show InChI InChI=1S/C25H27N3O2/c1-4-28(3,5-2)15-9-14-26-25(30)21-16-27-23-22-18(12-8-13-19(21)22)17-10-6-7-11-20(17)24(23)29/h6-8,10-13,16H,4-5,9,14-15H2,1-3H3/p+1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	650	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				Eur J Med Chem 44: 2523-32 (2009) Article DOI: 10.1016/j.ejmech.2009.01.021 BindingDB Entry DOI: 10.7270/Q2Z89CFV
					More data for this Ligand-Target Pair