BDBM50064033 CHEMBL3401011

SMILES: COc1cc2oc(cc(=O)c2c(O)c1OC)-c1ccc(OC(=O)N2CCOCC2)cc1

InChI Key: InChIKey=ZVKAJYVPPHSLND-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 = 50064033   

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 (Rattus norvegicus (rat))	BDBM50064033 (CHEMBL3401011) Show SMILES COc1cc2oc(cc(=O)c2c(O)c1OC)-c1ccc(OC(=O)N2CCOCC2)cc1 Show InChI InChI=1S/C22H21NO8/c1-27-18-12-17-19(20(25)21(18)28-2)15(24)11-16(31-17)13-3-5-14(6-4-13)30-22(26)23-7-9-29-10-8-23/h3-6,11-12,25H,7-10H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD 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
Sichuan University Curated by ChEMBL					Assay Description Inhibition of rat cortex AChE using acetylthiocholine iodide as substrate after 15 mins by Ellman method				Bioorg Med Chem 23: 668-80 (2015) Article DOI: 10.1016/j.bmc.2015.01.005 BindingDB Entry DOI: 10.7270/Q24T6M2R
					More data for this Ligand-Target Pair