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CHEBI:85994 - lenvatinib

Default Structure
ChEBI IDCHEBI:85994
ChEBI Namelenvatinib
Stars
DefinitionA member of the class of quinolines that is the carboxamide of 4-{3-chloro-4-[(cyclopropylcarbamoyl)amino]phenoxy}-7-methoxyquinoline-6-carboxylic acid. A multi-kinase inhibitor and orphan drug used (as its mesylate salt) for the treatment of various types of thyroid cancer that do not respond to radioiodine.
Last Modified20 May 2017
SubmitterSteve
DownloadsMolfile
FormulaC21H19ClN4O4
Net Charge0
Average Mass426.860
Monoisotopic Mass426.10948
SMILESCOc1cc2nccc(Oc3ccc(NC(=O)NC4CC4)c(Cl)c3)c2cc1C(N)=O
InChIInChI=1S/C21H19ClN4O4/c1-29-19-10-17-13(9-14(19)20(23)27)18(6-7-24-17)30-12-4-5-16(15(22)8-12)26-21(28)25-11-2-3-11/h4-11H,2-3H2,1H3,(H2,23,27)(H2,25,26,28)
InChIKeyWOSKHXYHFSIKNG-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Roles:
vascular endothelial growth factor receptor antagonist  An antagonist at the vascular endothelial growth factor receptor.
fibroblast growth factor receptor antagonist  An antagonist at the fibroblast growth factor receptor.
EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor  An EC 2.7.10.* (protein-tyrosine kinase) inhibitor that interferes with the action of receptor protein-tyrosine kinase (EC 2.7.10.1).
Applications:
orphan drug  Any drug that has been developed specifically for treatment of a rare medical condition, the condition itself being known as an orphan disease.
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
lenvatinib (CHEBI:85994) has role antineoplastic agent (CHEBI:35610)
lenvatinib (CHEBI:85994) has role EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor (CHEBI:62434)
lenvatinib (CHEBI:85994) has role fibroblast growth factor receptor antagonist (CHEBI:63457)
lenvatinib (CHEBI:85994) has role orphan drug (CHEBI:71031)
lenvatinib (CHEBI:85994) has role vascular endothelial growth factor receptor antagonist (CHEBI:65207)
lenvatinib (CHEBI:85994) is a aromatic amide (CHEBI:62733)
lenvatinib (CHEBI:85994) is a aromatic ether (CHEBI:35618)
lenvatinib (CHEBI:85994) is a cyclopropanes (CHEBI:51454)
lenvatinib (CHEBI:85994) is a monocarboxylic acid amide (CHEBI:29347)
lenvatinib (CHEBI:85994) is a monochlorobenzenes (CHEBI:83403)
lenvatinib (CHEBI:85994) is a phenylureas (CHEBI:134043)
lenvatinib (CHEBI:85994) is a quinolines (CHEBI:26513)
lenvatinib (CHEBI:85994) is conjugate base of lenvatinib(1+) (CHEBI:85998)
Incoming Relation(s)
lenvatinib(1+) (CHEBI:85998) is conjugate acid of lenvatinib (CHEBI:85994)
IUPAC Name 
4-{3-chloro-4-[(cyclopropylcarbamoyl)amino]phenoxy}-7-methoxyquinoline-6-carboxamide
INN  Source
lenvatinibKEGG DRUG
Synonyms  Source
4-(3-Chloro-4-(N'-cyclopropylureido)phenoxy)-7-methoxyquinoline-6-carboxamideChemIDplus
E 7080ChemIDplus
E7080ChemIDplus
UNII-EE083865G2ChemIDplus
Manual XrefsDatabases
4942DrugCentral
D09919KEGG DRUG
LenvatinibWikipedia
LEVPDBeChem
Registry NumbersSources
Reaxys:12096874Reaxys
CAS:417716-92-8KEGG DRUG
CAS:417716-92-8ChemIDplus
Citations