CHEBI:75991 - trametinib dimethyl sulfoxide

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ChEBI Name trametinib dimethyl sulfoxide
Definition An addition compound obtained by combining equimolar amounts of trametinib and dimethyl sulfoxide. Used for the treatment of patients with unresectable or metastatic melanoma with BRAF V600E or V600K mutations, and who have not received prior BRAF inhibitor treatment.
Stars This entity has been manually annotated by the ChEBI Team.
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Formulae C26H23FIN5O4.C2H6OS
Net Charge 0
Average Mass 693.52800
Monoisotopic Mass 693.09181
InChI InChI=1S/C26H23FIN5O4.C2H6OS/c1-13-22-21(23(31(3)24(13)35)30-20-10-7-15(28)11-19(20)27)25(36)33(17-8-9-17)26(37)32(22)18-6-4-5-16(12-18)29-14(2)34;1-4(2)3/h4-7,10-12,17,30H,8-9H2,1-3H3,(H,29,34);1-2H3
SMILES CS(C)=O.CC(=O)Nc1cccc(c1)-n1c2c(C)c(=O)n(C)c(Nc3ccc(I)cc3F)c2c(=O)n(C2CC2)c1=O
Roles Classification
Biological Role(s): EC (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
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
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ChEBI Ontology
Outgoing trametinib dimethyl sulfoxide (CHEBI:75991) has part dimethyl sulfoxide (CHEBI:28262)
trametinib dimethyl sulfoxide (CHEBI:75991) has part trametinib (CHEBI:75998)
trametinib dimethyl sulfoxide (CHEBI:75991) has role antineoplastic agent (CHEBI:35610)
trametinib dimethyl sulfoxide (CHEBI:75991) has role EC (mitogen-activated protein kinase) inhibitor (CHEBI:79091)
trametinib dimethyl sulfoxide (CHEBI:75991) is a addition compound (CHEBI:35504)
N-(3-{3-cyclopropyl-5-[(2-fluoro-4-iodophenyl)amino]-6,8-dimethyl-2,4,7-trioxo-3,4,6,7-tetrahydropyrido[4,3-d]pyrimidin-1(2H)-yl}phenyl)acetamide—(methylsulfinyl)methane (1/1)
Synonyms Sources
GSK1120212 ChemIDplus
GSK1120212B ChemIDplus
JTP 74057 ChemIDplus
Trametinib DMSO ChemIDplus
Brand Name Source
Mekinist KEGG DRUG
Manual Xrefs Databases
DB08911 DrugBank
Trametinib Wikipedia
WO2005121142 Patent
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Registry Numbers Types Sources
1187431-43-1 CAS Registry Number KEGG DRUG
1187431-43-1 CAS Registry Number ChemIDplus
12497280 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
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Last Modified
21 October 2013