BDBM50025146 2-(4-Cyano-phenyl)-N-hydroxy-2-oxo-thioacetimidic acid 2-diethylamino-ethyl ester; hydrochloride::CHEMBL543779

SMILES: CCN(CC)CCSC(N=O)C(=O)c1ccc(cc1)C#N

InChI Key: InChIKey=GFCAGMRSRCKUPC-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50025146   

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 (Homo sapiens (Human))	BDBM50025146 (2-(4-Cyano-phenyl)-N-hydroxy-2-oxo-thioacetimidic ...) Show SMILES CCN(CC)CCSC(N=O)C(=O)c1ccc(cc1)C#N Show InChI InChI=1S/C15H19N3O2S/c1-3-18(4-2)9-10-21-15(17-20)14(19)13-7-5-12(11-16)6-8-13/h5-8,15H,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	1.80E+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