tideglusib (CHEBI:147398)

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ChEBI Name	tideglusib

ChEBI ID	CHEBI:147398

Definition	A member of the class of thiadiazolidines that is 1,2,4-thiadiazolidine-3,5-dione which is substituted by a naphthalen-1-yl group at position 2 and by a benzyl group at position 4. It is a non-ATP competitive inhibitor of glycogen synthase kinase 3β (GSK3β) and has neuroprotective effects. Currently under clinical investigation for the treatment of Alzheimer's disease and progressive supranuclear palsy.

Stars	This entity has been manually annotated by the ChEBI Team.

Submitter	Kalpana P

Supplier Information	ChemicalBook:CB22589642, Selleckchem:tideglusib, ZINC000013985228

Download	Molfile XML SDF

Wikipedia	License
Tideglusib (NP-12, NP031112) is a potent and irreversible small molecule glycogen synthase kinase 3 (GSK-3) inhibitor.
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Formula

C19H14N2O2S

Net Charge

Average Mass

334.390

Monoisotopic Mass

334.07760

InChI

InChI=1S/C19H14N2O2S/c22-18-20(13-14-7-2-1-3-8-14)19(23)24-21(18)17-12-6-10-15-9-4-5-11-16(15)17/h1-12H,13H2

InChIKey

PMJIHLSCWIDGMD-UHFFFAOYSA-N

SMILES

O=C1N(C=2C3=C(C=CC=C3)C=CC2)SC(=O)N1CC4=CC=CC=C4

Roles Classification
Biological Role(s):	EC 2.7.11.26 (tau-protein kinase) inhibitor An EC 2.7.11.* (protein-serine/threonine kinase) inhibitor that interferes with the action of tau-protein kinase inhibitor (EC 2.7.11.26). apoptosis inducer Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms.

Application(s):	neuroprotective agent Any compound that can be used for the treatment of neurodegenerative disorders. anti-inflammatory agent Any compound that has anti-inflammatory effects.

ChEBI Ontology
Outgoing	tideglusib (CHEBI:147398) has role anti-inflammatory agent (CHEBI:67079) tideglusib (CHEBI:147398) has role apoptosis inducer (CHEBI:68495) tideglusib (CHEBI:147398) has role EC 2.7.11.26 (tau-protein kinase) inhibitor (CHEBI:91092) tideglusib (CHEBI:147398) has role neuroprotective agent (CHEBI:63726) tideglusib (CHEBI:147398) is a benzenes (CHEBI:22712) tideglusib (CHEBI:147398) is a naphthalenes (CHEBI:25477) tideglusib (CHEBI:147398) is a thiadiazolidine (CHEBI:48865)

IUPAC Name

4-benzyl-2-(naphthalen-1-yl)-1,2,4-thiadiazolidine-3,5-dione

Registry Number	Type	Source
865854-05-3	CAS Registry Number	ChemIDplus

Last Modified

07 April 2020