SB 203580 (CHEBI:90705)

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ChEBI Name	SB 203580

ChEBI ID	CHEBI:90705

Definition	A member of the class of imidazoles carrying 4-methylsulfinylphenyl, 4-pyridyl and 4-fluorophenyl substituents at positions 2, 4 and 5 respectively. An inhibitor of mitogen-activated protein kinase.

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

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Formula

C21H16FN3OS

Net Charge

Average Mass

377.437

Monoisotopic Mass

377.09981

InChI

InChI=1S/C21H16FN3OS/c1-27(26)18-8-4-16(5-9-18)21-24-19(14-2-6-17(22)7-3-14)20(25-21)15-10-12-23-13-11-15/h2-13H,1H3,(H,24,25)

InChIKey

CDMGBJANTYXAIV-UHFFFAOYSA-N

SMILES

S(C=1C=CC(C2=NC(C=3C=CN=CC3)=C(N2)C4=CC=C(C=C4)F)=CC1)(C)=O

Roles Classification
Biological Role(s):	EC 2.7.11.24 (mitogen-activated protein kinase) inhibitor An EC 2.7.11.* (protein-serine/threonine kinase) inhibitor that interferes with the action of mitogen-activated protein kinase (EC 2.7.11.24). Hsp90 inhibitor An EC 3.6.4.10 (non-chaperonin molecular chaperone ATPase) inhibitor that blocks the action of heat shock protein 90. EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor An EC 2.7.11.* (protein-serine/threonine kinase) inhibitor that interferes with the action of non-specific serine/threonine protein kinase (EC 2.7.11.1), a kinase enzyme involved in phosphorylation of hydroxy group of serine or threonine.

Application(s):	neuroprotective agent Any compound that can be used for the treatment of neurodegenerative disorders. geroprotector Any compound that supports healthy aging, slows the biological aging process, or extends lifespan.

ChEBI Ontology
Outgoing	SB 203580 (CHEBI:90705) has role EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor (CHEBI:50925) SB 203580 (CHEBI:90705) has role EC 2.7.11.24 (mitogen-activated protein kinase) inhibitor (CHEBI:79091) SB 203580 (CHEBI:90705) has role geroprotector (CHEBI:176497) SB 203580 (CHEBI:90705) has role Hsp90 inhibitor (CHEBI:63962) SB 203580 (CHEBI:90705) has role neuroprotective agent (CHEBI:63726) SB 203580 (CHEBI:90705) is a imidazoles (CHEBI:24780) SB 203580 (CHEBI:90705) is a monofluorobenzenes (CHEBI:83575) SB 203580 (CHEBI:90705) is a pyridines (CHEBI:26421) SB 203580 (CHEBI:90705) is a sulfoxide (CHEBI:22063)

IUPAC Name

4-{4-(4-fluorophenyl)-2-[4-(methanesulfinyl)phenyl]-1H-imidazol-5-yl}pyridine

Synonyms	Sources
4-(4-Fluorophenyl)-2-(4-methylsulfinylphenyl)-5-(4-pyridyl)-1H-imidazole	ChemIDplus
SB-203580	ChemIDplus
SB203580	ChEBI

Last Modified

28 October 2021