BDBM50534619 CHEMBL4458007

SMILES: O=c1cc(OCCCCN2CCN(CC2)c2ccccn2)c2ccccc2o1

InChI Key: InChIKey=MEWGZATZSHHDTE-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 = 50534619   

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 (Mus musculus (mouse))	BDBM50534619 (CHEMBL4458007) Show SMILES O=c1cc(OCCCCN2CCN(CC2)c2ccccn2)c2ccccc2o1 Show InChI InChI=1S/C22H25N3O3/c26-22-17-20(18-7-1-2-8-19(18)28-22)27-16-6-5-11-24-12-14-25(15-13-24)21-9-3-4-10-23-21/h1-4,7-10,17H,5-6,11-16H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.76E+4	n/a	n/a	n/a	n/a	n/a	n/a
Panjab University Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase in Albino LACA mouse brain homogenates using acetylthiocholine iodide as substrate measured for 2 mins by Ellman's...				Bioorg Med Chem 24: 4587-4599 (2016) Article DOI: 10.1016/j.bmc.2016.07.061
					More data for this Ligand-Target Pair