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CHEBI:90705 - SB 203580

ChEBI IDCHEBI:90705
ChEBI NameSB 203580
Stars
DefinitionA 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.
Last Modified28 October 2021
SubmitterSteve
DownloadsMolfile
FormulaC21H16FN3OS
Net Charge0
Average Mass377.444
Monoisotopic Mass377.09981
SMILESCS(=O)c1ccc(-c2nc(-c3ccncc3)c(-c3ccc(F)cc3)n2)cc1
InChIInChI=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)
InChIKeyCDMGBJANTYXAIV-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Roles:
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.
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.
Applications:
geroprotector  Any compound that supports healthy aging, slows the biological aging process, or extends lifespan.
neuroprotective agent  Any compound that can be used for the treatment of neurodegenerative disorders.
ChEBI Ontology
Outgoing Relation(s)
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  Source
SB203580ChEBI
4-(4-Fluorophenyl)-2-(4-methylsulfinylphenyl)-5-(4-pyridyl)-1H-imidazoleChemIDplus
SB-203580ChemIDplus
Manual XrefsDatabases
LSM-1168LINCS
HMDB0244686HMDB
SB_203580Wikipedia
Registry NumbersSources
Reaxys:8078222Reaxys
CAS:152121-47-6ChemIDplus
Citations