BDBM50468997 CHEMBL4294906

SMILES: Cl.Cl.Nc1ccc(O)c(CN2CCOCC2)c1

InChI Key: InChIKey=SEMWVZDOPKFQFT-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 = 50468997   

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 (Homo sapiens (Human))	BDBM50468997 (CHEMBL4294906) Show SMILES Cl.Cl.Nc1ccc(O)c(CN2CCOCC2)c1 Show InChI InChI=1S/C11H16N2O2/c12-10-1-2-11(14)9(7-10)8-13-3-5-15-6-4-13/h1-2,7,14H,3-6,8,12H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.71E+5	n/a	n/a	n/a	n/a	n/a	n/a
TNO Curated by ChEMBL					Assay Description Inhibition of AChE in human erythrocytes using acetylthiocholine as substrate measured for 1 min				Eur J Med Chem 157: 151-160 (2018) Article DOI: 10.1016/j.ejmech.2018.08.016 BindingDB Entry DOI: 10.7270/Q2FF3W3C
					More data for this Ligand-Target Pair