Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Acetylcholinesterase' and Ligand = 'BDBM50025141'   

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))	BDBM50025141 (2-(4-Bromo-phenyl)-N-hydroxy-2-oxo-thioacetimidic ...) Show SMILES CCN(CC)CCSC(N=O)C(=O)c1ccc(Br)cc1 Show InChI InChI=1S/C14H19BrN2O2S/c1-3-17(4-2)9-10-20-14(16-19)13(18)11-5-7-12(15)8-6-11/h5-8,14H,3-4,9-10H2,1-2H3	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	2.10E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Reversible inhibition of Human AchE				J Med Chem 29: 1689-96 (1986) BindingDB Entry DOI: 10.7270/Q2TH8N8Q
					More data for this Ligand-Target Pair