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SMILES: COc1cc(\C=C\C(=O)Nc2ccccc2)ccc1OCCN1CCCCC1

InChI Key: InChIKey=SUCBPGDIKUCNLJ-ACCUITESSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50232236   

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
Cholinesterase (Homo sapiens (Human))	BDBM50232236 (CHEMBL4095695) Show SMILES COc1cc(\C=C\C(=O)Nc2ccccc2)ccc1OCCN1CCCCC1 Show InChI InChI=1S/C23H28N2O3/c1-27-22-18-19(11-13-23(26)24-20-8-4-2-5-9-20)10-12-21(22)28-17-16-25-14-6-3-7-15-25/h2,4-5,8-13,18H,3,6-7,14-17H2,1H3,(H,24,26)/b13-11+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.30	n/a	n/a	n/a	n/a	n/a	n/a
Hu'nan University Curated by ChEMBL					Assay Description Inhibition of butyrylcholinesterase (unknown origin) using butyrylthiocholine iodide as substrate after 25 mins by Ellmann method				Eur J Med Chem 126: 810-822 (2017) BindingDB Entry DOI: 10.7270/Q2HH6N9M
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50232236 (CHEMBL4095695) Show SMILES COc1cc(\C=C\C(=O)Nc2ccccc2)ccc1OCCN1CCCCC1 Show InChI InChI=1S/C23H28N2O3/c1-27-22-18-19(11-13-23(26)24-20-8-4-2-5-9-20)10-12-21(22)28-17-16-25-14-6-3-7-15-25/h2,4-5,8-13,18H,3,6-7,14-17H2,1H3,(H,24,26)/b13-11+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
Hu'nan University Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase (unknown origin) using acetylthiocholine iodide as substrate after 25 mins by Ellmann method				Eur J Med Chem 126: 810-822 (2017) BindingDB Entry DOI: 10.7270/Q2HH6N9M
					More data for this Ligand-Target Pair