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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.
Term:AZT-1152
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Accession:CHEBI:167636 term browser browse the term
Definition:A dihydrogen phosphate prodrug of a pyrazoloquinazoline aurora kinase inhibitor AZD1152-hydroxyquinazoline pyrazol anilide(HQPA) and is converted rapidly to the active AZD1152-HQPA in plasma.
Synonyms:exact_synonym: 2-[ethyl(3-{[4-({5-[2-(3-fluoroanilino)-2-oxoethyl]-1H-pyrazol-3-yl}amino)quinazolin-7-yl]oxy}propyl)amino]ethyl dihydrogen phosphate
 related_synonym: AZD1152-HQPA dihydrogen phosphate;   AZD2811;   Formula=C26H31FN7O6P;   INH-34;   InChI=1S/C26H31FN7O6P/c1-2-34(10-12-40-41(36,37)38)9-4-11-39-21-7-8-22-23(16-21)28-17-29-26(22)31-24-14-20(32-33-24)15-25(35)30-19-6-3-5-18(27)13-19/h3,5-8,13-14,16-17H,2,4,9-12,15H2,1H3,(H,30,35)(H2,36,37,38)(H2,28,29,31,32,33);   InChIKey=GBJVVSCPOBPEIT-UHFFFAOYSA-N;   SMILES=CCN(CCCOC1=CC2=C(C=C1)C(NC1=NNC(CC(=O)NC3=CC(F)=CC=C3)=C1)=NC=N2)CCOP(O)(O)=O;   barasertib;   barasertibum
 xref: CAS:722543-31-9;   CAS:957881-03-7;   DrugBank:DB11747;   PMCID:PMC4108943;   PMID:21565405;   PMID:21626115;   PMID:21679421;   PMID:21976672;   PMID:22661287;   PMID:22864876;   PMID:23315030;   PMID:23557198;   PMID:23605952;   PMID:23763917;   PMID:24598913;   PMID:26637878;   PMID:26993175;   PMID:27069145;   PMID:27496133;   PMID:28292940;   PMID:29491065;   PMID:30540594;   PMID:30872381;   PMID:32968211


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Term Annotations click to browse term
  CHEBI ontology 5052
    role 5044
      application 863
        pro-agent 40
          prodrug 23
            AZT-1152 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 5052
    subatomic particle 5043
      composite particle 5043
        hadron 5071
          baryon 5043
            nucleon 5043
              atomic nucleus 5043
                atom 5043
                  main group element atom 5013
                    main group molecular entity 5012
                      s-block molecular entity 4970
                        hydrogen molecular entity 4964
                          hydrides 4544
                            inorganic hydride 403
                              pnictogen hydride 399
                                nitrogen hydride 399
                                  azane 391
                                    ammonia 391
                                      organic amino compound 284
                                        primary amino compound 52
                                          primary amine 2
                                            primary arylamine 1
                                              aniline 1
                                                anilide 1
                                                  AZD-1152 0
                                                    AZT-1152 0
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