Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Acetylcholinesterase' and Ligand = 'BDBM50279983'   

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 (Homo sapiens (Human))	BDBM50279983 (8-Methyl-1,2,3,4-tetrahydro-acridin-9-ylamine | CH...) Show SMILES Cc1cccc2nc3CCCCc3c(N)c12 Show InChI InChI=1S/C14H16N2/c1-9-5-4-8-12-13(9)14(15)10-6-2-3-7-11(10)16-12/h4-5,8H,2-3,6-7H2,1H3,(H2,15,16)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	99	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro inhibition of acetylcholinesterase isolated from human erythrocytes.				Bioorg Med Chem Lett 1: 411-414 (1991) Article DOI: 10.1016/S0960-894X(00)80267-X BindingDB Entry DOI: 10.7270/Q2G73DN0
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50279983 (8-Methyl-1,2,3,4-tetrahydro-acridin-9-ylamine | CH...) Show SMILES Cc1cccc2nc3CCCCc3c(N)c12 Show InChI InChI=1S/C14H16N2/c1-9-5-4-8-12-13(9)14(15)10-6-2-3-7-11(10)16-12/h4-5,8H,2-3,6-7H2,1H3,(H2,15,16)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	125	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human recombinant AChE assessed as reduction in cholinesterase activity using acetylthiocholine iodide as substrate by Ellman's method				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113434 BindingDB Entry DOI: 10.7270/Q2PC365G
					More data for this Ligand-Target Pair