Submit Data |  Help |  Video Tutorials |  News |  Publications |  FTP Download |  REST API |  Citing RGD |  Contact   

ONTOLOGY REPORT - ANNOTATIONS


Term:alectinib
go back to main search page
Accession:CHEBI:90936 term browser browse the term
Definition:An organic heterotetracyclic compound that is 6,6-dimethyl-5,6-dihydro-11H-benzo[b]carbazol-11-one carrying additional cyano, 4-(morpholin-4-yl)piperidin-1-yl and ethyl substituents at positions 3, 8 and 9 respectively. Used (as the hydrochloride salt) for the treatment of patients with anaplastic lymphoma kinase-positive, metastatic non-small cell lung cancer.
Synonyms:exact_synonym: 9-ethyl-6,6-dimethyl-8-[4-(morpholin-4-yl)piperidin-1-yl]-11-oxo-6,11-dihydro-5H-benzo[b]carbazole-3-carbonitrile
 related_synonym: AF 802;   CH 5424802;   CH5424802;   Formula=C30H34N4O2;   InChI=1S/C30H34N4O2/c1-4-20-16-23-24(17-26(20)34-9-7-21(8-10-34)33-11-13-36-14-12-33)30(2,3)29-27(28(23)35)22-6-5-19(18-31)15-25(22)32-29/h5-6,15-17,21,32H,4,7-14H2,1-3H3;   InChIKey=KDGFLJKFZUIJMX-UHFFFAOYSA-N;   SMILES=C1OCCN(C1)C2CCN(CC2)C3=CC4=C(C=C3CC)C(C5=C(C4(C)C)NC=6C5=CC=C(C6)C#N)=O
 xref: CAS:1256580-46-7 "ChemIDplus";   CAS:1256580-46-7 "KEGG DRUG";   Drug_Central:4937 "DrugCentral";   KEGG:D10542;   LINCS:LSM-1202
 xref_mesh: MESH:C582670
 xref: PDBeChem:EMH;   PMID:24736079 "Europe PMC";   PMID:24887559 "Europe PMC";   PMID:25205428 "Europe PMC";   PMID:25228534 "Europe PMC";   PMID:25349307 "Europe PMC";   PMID:25398579 "Europe PMC";   PMID:25428710 "Europe PMC";   PMID:25502629 "Europe PMC";   PMID:25526238 "Europe PMC";   PMID:25556163 "Europe PMC";   PMID:25678258 "Europe PMC";   PMID:25736571 "Europe PMC";   PMID:25876560 "Europe PMC";   PMID:26464158 "Europe PMC";   PMID:26487585 "Europe PMC";   PMID:26579422 "Europe PMC";   PMID:26682573 "Europe PMC";   PMID:26739884 "Europe PMC";   PMID:26751586 "Europe PMC";   PMID:26752591 "Europe PMC";   PMID:26753004 "Europe PMC";   Reaxys:22302431 "Reaxys";   Wikipedia:Alectinib
 cyclic_relationship: is_conjugate_base_of CHEBI:90937


show annotations for term's descendants       view all columns           Sort by:
 
alectinib term browser
Symbol Object Name JBrowse Chr Start Stop Reference
G Alk ALK receptor tyrosine kinase JBrowse link 6 22,696,415 23,203,791 RGD:6480464
G Gpt glutamic--pyruvic transaminase JBrowse link 7 117,759,083 117,761,932 RGD:6480464

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19764
    chemical entity 19763
      group 19672
        pseudohalo group 2774
          cyano group 2774
            nitrile 2774
              alectinib 2
Path 2
Term Annotations click to browse term
  CHEBI ontology 19764
    subatomic particle 19762
      composite particle 19762
        hadron 19762
          baryon 19762
            nucleon 19762
              atomic nucleus 19762
                atom 19762
                  main group element atom 19646
                    p-block element atom 19646
                      carbon group element atom 19540
                        carbon atom 19529
                          organic molecular entity 19529
                            organic group 18432
                              organic divalent group 18423
                                organodiyl group 18423
                                  carbonyl group 18311
                                    carbonyl compound 18311
                                      ketone 15925
                                        aromatic ketone 11828
                                          alectinib 2
paths to the root

NHLBI Logo

RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.