BDBM50260299 CHEMBL4088294

SMILES: COc1cc2CCN(Cc3ccc(O)c(\C=N\O)c3)Cc2cc1OC

InChI Key: InChIKey=ROJUKRFTKWTBRU-KEBDBYFISA-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 = 50260299   

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))	BDBM50260299 (CHEMBL4088294) Show SMILES COc1cc2CCN(Cc3ccc(O)c(\C=N\O)c3)Cc2cc1OC Show InChI InChI=1S/C19H22N2O4/c1-24-18-8-14-5-6-21(12-16(14)9-19(18)25-2)11-13-3-4-17(22)15(7-13)10-20-23/h3-4,7-10,22-23H,5-6,11-12H2,1-2H3/b20-10+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.59E+5	n/a	n/a	n/a	n/a	n/a	n/a
Fourth Military Medical University Curated by ChEMBL					Assay Description Inhibition of human AChE using acetylthiocholine as substrate preincubated for 30 mins followed by substrate addition measured every 5 mins for 20 mi...				Bioorg Med Chem 25: 4497-4505 (2017) Article DOI: 10.1016/j.bmc.2017.06.041 BindingDB Entry DOI: 10.7270/Q2SJ1P2T
					More data for this Ligand-Target Pair