null

SMILES: COc1ccc(c(OC)c1)S(=O)(=O)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1

InChI Key: InChIKey=JRLCTCNKQQZBID-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50513309   

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 (Electrophorus electricus (Electric eel))	BDBM50513309 (CHEMBL4437151) Show SMILES COc1ccc(c(OC)c1)S(=O)(=O)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 Show InChI InChI=1S/C26H22N4O5S/c1-34-16-8-10-23(22(14-16)35-2)36(32,33)29-15-7-9-21-19(13-15)26(31)30-12-11-18-17-5-3-4-6-20(17)27-24(18)25(30)28-21/h3-10,13-14,27,29H,11-12H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
Anhui Medical University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 30 mins followed by substrate addition and measured afte...				Eur J Med Chem 177: 198-211 (2019) Article DOI: 10.1016/j.ejmech.2019.05.055
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50513309 (CHEMBL4437151) Show SMILES COc1ccc(c(OC)c1)S(=O)(=O)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 Show InChI InChI=1S/C26H22N4O5S/c1-34-16-8-10-23(22(14-16)35-2)36(32,33)29-15-7-9-21-19(13-15)26(31)30-12-11-18-17-5-3-4-6-20(17)27-24(18)25(30)28-21/h3-10,13-14,27,29H,11-12H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.58E+3	n/a	n/a	n/a	n/a	n/a	n/a
Anhui Medical University Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using S-butyrylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition a...				Eur J Med Chem 177: 198-211 (2019) Article DOI: 10.1016/j.ejmech.2019.05.055
					More data for this Ligand-Target Pair