EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:91435 - linifanib

Default Structure
ChEBI IDCHEBI:91435
ChEBI Namelinifanib
Stars
DefinitionA member of the class of phenylureas that is urea in which one of the nitrogens is substituted by a 2-fluoro-5-methylphenyl group, while the other is substituted by a p-(3-amino-1H-indazol-4-yl)phenyl group. It is a potent, selective inhibitor of vascular endothelial growth factor and platelet-derived growth factor receptor tyrosine kinases.
Last Modified10 December 2016
DownloadsMolfile
FormulaC21H18FN5O
Net Charge0
Average Mass375.407
Monoisotopic Mass375.14954
SMILESCc1ccc(F)c(NC(=O)Nc2ccc(-c3cccc4nnc(N)c34)cc2)c1
InChIInChI=1S/C21H18FN5O/c1-12-5-10-16(22)18(11-12)25-21(28)24-14-8-6-13(7-9-14)15-3-2-4-17-19(15)20(23)27-26-17/h2-11H,1H3,(H3,23,26,27)(H2,24,25,28)
InChIKeyMPVGZUGXCQEXTM-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
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:
angiogenesis inhibitor  An agent and endogenous substances that antagonize or inhibit the development of new blood vessels.
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
linifanib (CHEBI:91435) has role angiogenesis inhibitor (CHEBI:48422)
linifanib (CHEBI:91435) has role antineoplastic agent (CHEBI:35610)
linifanib (CHEBI:91435) has role EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor (CHEBI:62434)
linifanib (CHEBI:91435) is a aromatic amine (CHEBI:33860)
linifanib (CHEBI:91435) is a indazoles (CHEBI:38769)
linifanib (CHEBI:91435) is a phenylureas (CHEBI:134043)
INNs  Source
linifanibWHO MedNet
linifanibWHO MedNet
linifanibWHO MedNet
linifanibumWHO MedNet
Synonyms  Source
1-[4-(3-amino-1H-indazol-4-yl)phenyl]-3-(2-fluoro-5-methylphenyl)ureaLINCS
ABT 869ChemIDplus
ABT-869ChemIDplus
ABT869ChEBI
N-[4-(3-amino-1H-indazol-4-yl)phenyl]-N'-(2-fluoro-5-methylphenyl)ureaChemIDplus
Manual XrefsDatabases
D09635KEGG DRUG
LinifanibWikipedia
LSM-1183LINCS
Registry NumbersSources
Reaxys:11008713Reaxys
CAS:796967-16-3KEGG DRUG
CAS:796967-16-3ChemIDplus
Citations