BDBM50318726 3-((methyl(3-(3-oxo-2-(3,4,5-trihydroxybenzylidene)-2,3-dihydrobenzofuran-6-yloxy)propyl)amino)methyl)phenyl methylcarbamate::CHEMBL1083374

SMILES: CNC(=O)Oc1cccc(CN(C)CCCOc2ccc3C(=O)C(Oc3c2)=Cc2cc(O)c(O)c(O)c2)c1

InChI Key: InChIKey=YMJAIDWXOYOGGU-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 = 50318726   

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))	BDBM50318726 (3-((methyl(3-(3-oxo-2-(3,4,5-trihydroxybenzylidene...) Show SMILES CNC(=O)Oc1cccc(CN(C)CCCOc2ccc3C(=O)C(Oc3c2)=Cc2cc(O)c(O)c(O)c2)c1 |w:27.29| Show InChI InChI=1S/C28H28N2O8/c1-29-28(35)37-20-6-3-5-17(11-20)16-30(2)9-4-10-36-19-7-8-21-24(15-19)38-25(26(21)33)14-18-12-22(31)27(34)23(32)13-18/h3,5-8,11-15,31-32,34H,4,9-10,16H2,1-2H3,(H,29,35)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.99	n/a	n/a	n/a	n/a	n/a	n/a
Sichuan University Curated by ChEMBL					Assay Description Inhibition of AChE				Eur J Med Chem 45: 1167-72 (2010) Article DOI: 10.1016/j.ejmech.2009.12.038 BindingDB Entry DOI: 10.7270/Q25H7GFM
					More data for this Ligand-Target Pair