Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Acetylcholinesterase' and Ligand = 'BDBM50234822'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50234822 (CHEMBL4099799) Show SMILES CCN(Cc1ccc(cc1)N(C)C)Cc1ccc(\C=C2/Oc3cc(OC)c(OC)cc3C2=O)cc1O Show InChI InChI=1S/C29H32N2O5/c1-6-31(17-19-8-11-22(12-9-19)30(2)3)18-21-10-7-20(13-24(21)32)14-28-29(33)23-15-26(34-4)27(35-5)16-25(23)36-28/h7-16,32H,6,17-18H2,1-5H3/b28-14-	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.88E+5	n/a	n/a	n/a	n/a	n/a	n/a
Sichuan University Curated by ChEMBL					Assay Description Inhibition of AChE in rat brain cortex homogenates using acetylthiocholine iodide as substrate in presence of BuChE inhibitor tetraisopropyl pyrophos...				Eur J Med Chem 126: 762-775 (2017) Article DOI: 10.1016/j.ejmech.2016.12.009 BindingDB Entry DOI: 10.7270/Q2NG4SW1
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50234822 (CHEMBL4099799) Show SMILES CCN(Cc1ccc(cc1)N(C)C)Cc1ccc(\C=C2/Oc3cc(OC)c(OC)cc3C2=O)cc1O Show InChI InChI=1S/C29H32N2O5/c1-6-31(17-19-8-11-22(12-9-19)30(2)3)18-21-10-7-20(13-24(21)32)14-28-29(33)23-15-26(34-4)27(35-5)16-25(23)36-28/h7-16,32H,6,17-18H2,1-5H3/b28-14-	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.31E+5	n/a	n/a	n/a	n/a	n/a	n/a
Sichuan University Curated by ChEMBL					Assay Description Inhibition of Electrophorus electricus AChE using acetylthiocholine iodide as substrate measured after 15 mins by Ellman's method				Eur J Med Chem 126: 762-775 (2017) Article DOI: 10.1016/j.ejmech.2016.12.009 BindingDB Entry DOI: 10.7270/Q2NG4SW1
					More data for this Ligand-Target Pair