CHEBI:72317 - cabozantinib

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ChEBI Name cabozantinib ChEBI ID CHEBI:72317 Definition A dicarboxylic acid diamide that is N-phenyl-N'-(4-fluorophenyl)cyclopropane-1,1-dicarboxamide in which the hydrogen at position 4 on the phenyl ring is substituted by a (6,7-dimethoxyquinolin-4-yl)oxy group. A multi-tyrosine kinase inhibitor, used (as its malate salt) for the treatment of progressive, metastatic, medullary thyroid cancer. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Wikipedia License Read full article at Wikipedia Formula C28H24FN3O5 Net Charge 0 Average Mass 501.50570 Monoisotopic Mass 501.17000 InChI InChI=1S/C28H24FN3O5/c1-35-24-15-21-22(16-25(24)36-2)30-14-11-23(21)37-20-9-7-19(8-10-20)32-27(34)28(12-13-28)26(33)31-18-5-3-17(29)4-6-18/h3-11,14-16H,12-13H2,1-2H3,(H,31,33)(H,32,34) InChIKey ONIQOQHATWINJY-UHFFFAOYSA-N SMILES COc1cc2nccc(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3)c2cc1OC Roles Classification Biological Role(s): tyrosine kinase inhibitor Any protein kinase inhibitor that interferes with the action of tyrosine kinase. Application(s): antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms. View more via ChEBI Ontology ChEBI Ontology Outgoing cabozantinib (CHEBI:72317) has role antineoplastic agent (CHEBI:35610) cabozantinib (CHEBI:72317) has role tyrosine kinase inhibitor (CHEBI:38637) cabozantinib (CHEBI:72317) is a aromatic ether (CHEBI:35618) cabozantinib (CHEBI:72317) is a dicarboxylic acid diamide (CHEBI:35779) cabozantinib (CHEBI:72317) is a organofluorine compound (CHEBI:37143) cabozantinib (CHEBI:72317) is a quinolines (CHEBI:26513) Incoming cabozantinib malate (CHEBI:72319) has part cabozantinib (CHEBI:72317) IUPAC Name N-{4-[(6,7-dimethoxyquinolin-4-yl)oxy]phenyl}-N'-(4-fluorophenyl)cyclopropane-1,1-dicarboxamide Synonyms Sources BMS 907351 ChemIDplus BMS-907351 ChemIDplus XL 184 ChemIDplus XL-184 ChemIDplus XL184 ChemIDplus Manual Xrefs Databases 4715 DrugCentral Cabozantinib Wikipedia D10062 KEGG DRUG LSM-1195 LINCS WO2012109510 Patent View more database links Registry Numbers Types Sources 18631644 Reaxys Registry Number Reaxys 849217-68-1 CAS Registry Number KEGG DRUG 849217-68-1 CAS Registry Number ChemIDplus Citations Types Sources 20127563 PubMed citation Europe PMC 21314233 PubMed citation Europe PMC 21460789 PubMed citation Europe PMC 21606412 PubMed citation Europe PMC 21613405 PubMed citation Europe PMC 21860001 PubMed citation Europe PMC 21862995 PubMed citation Europe PMC 21926191 PubMed citation Europe PMC 22146228 PubMed citation Europe PMC 22585997 PubMed citation Europe PMC 23104465 PubMed citation Europe PMC 23169517 PubMed citation Europe PMC 23248244 PubMed citation Europe PMC 23292257 PubMed citation Europe PMC 23292795 PubMed citation Europe PMC 23319755 PubMed citation Europe PMC 23319797 PubMed citation Europe PMC 23319867 PubMed citation Europe PMC 23335077 PubMed citation Europe PMC 23337762 PubMed citation Europe PMC 23337763 PubMed citation Europe PMC 23375349 PubMed citation Europe PMC Last Modified 22 February 2017