BDBM50435595 CHEMBL2393503

SMILES: O=C(CCCOc1cc(=O)oc2ccccc12)N1CCN(CC1)c1ccccc1

InChI Key: InChIKey=SOZXYTKALVQKGY-UHFFFAOYSA-N

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 = 50435595   

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
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50435595 (CHEMBL2393503) Show SMILES O=C(CCCOc1cc(=O)oc2ccccc12)N1CCN(CC1)c1ccccc1 Show InChI InChI=1S/C23H24N2O4/c26-22(25-14-12-24(13-15-25)18-7-2-1-3-8-18)11-6-16-28-21-17-23(27)29-20-10-5-4-9-19(20)21/h1-5,7-10,17H,6,11-16H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Zanjan Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 10 mins prior to substrate addition by Ellman's method				Eur J Med Chem 64: 252-9 (2013) Article DOI: 10.1016/j.ejmech.2013.03.021 BindingDB Entry DOI: 10.7270/Q2ZG6TNV
					More data for this Ligand-Target Pair
Butyrylcholinesterase (BuChE) (Equus caballus (Horse))	BDBM50435595 (CHEMBL2393503) Show SMILES O=C(CCCOc1cc(=O)oc2ccccc12)N1CCN(CC1)c1ccccc1 Show InChI InChI=1S/C23H24N2O4/c26-22(25-14-12-24(13-15-25)18-7-2-1-3-8-18)11-6-16-28-21-17-23(27)29-20-10-5-4-9-19(20)21/h1-5,7-10,17H,6,11-16H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Zanjan Curated by ChEMBL					Assay Description Inhibition of equine serum BChE using butylthiocholine iodide as substrate preincubated for 10 mins prior to substrate addition by Ellman's method				Eur J Med Chem 64: 252-9 (2013) Article DOI: 10.1016/j.ejmech.2013.03.021 BindingDB Entry DOI: 10.7270/Q2ZG6TNV
					More data for this Ligand-Target Pair