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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:abiraterone
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Accession:CHEBI:68642 term browser browse the term
Definition:A 3beta-sterol that is androsta-5,16-dien-3beta-ol substituted at position 17 by a 3-pyridyl group. Administered as the O-acetate, it is used for treatment of metastatic castrate-resistant prostate cancer.
Synonyms:exact_synonym: 17-(pyridin-3-yl)androsta-5,16-dien-3beta-ol
 related_synonym: (3beta)-17-(pyridin-3-yl)androsta-5,16-dien-3-ol;   17-(3-Pyridyl)androsta-5,16-dien-3beta-ol;   Formula=C24H31NO;   InChI=1S/C24H31NO/c1-23-11-9-18(26)14-17(23)5-6-19-21-8-7-20(16-4-3-13-25-15-16)24(21,2)12-10-22(19)23/h3-5,7,13,15,18-19,21-22,26H,6,8-12,14H2,1-2H3/t18-,19-,21-,22-,23-,24+/m0/s1;   InChIKey=GZOSMCIZMLWJML-VJLLXTKPSA-N;   SMILES=[H][C@@]12CC=C3C[C@@H](O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)C(=CC[C@@]21[H])c1cccnc1
 xref: CAS:154229-19-3
 xref_mesh: MESH:C089740
 xref: PDBeChem:AER;   PMID:21093995;   PMID:21239011;   PMID:21242338;   PMID:21326154;   PMID:21612468;   PMID:21729712;   PMID:21743442;   PMID:21807635;   PMID:21808270;   PMID:21857690;   PMID:21864180;   PMID:21864181;   PMID:21864182;   PMID:21878199;   PMID:22002259;   PMID:22170708;   PMID:22266943;   PMID:22331349;   PMID:22373884;   PMID:22402426;   PMID:22411952;   PMID:22451619;   PMID:22500680;   PMID:22611169;   PMID:22753664;   PMID:22763809;   PMID:22822591;   PMID:22915660;   PMID:23024987;   Patent:EP1336602;   Patent:US2011034428;   Patent:US5604213;   Patent:WO2012083112;   Reaxys:7309269;   Wikipedia:Abiraterone


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abiraterone term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Ar androgen receptor decreases response to substance ISO AR alternative form results in decreased susceptibility to abiraterone CTD PMID:25908785 NCBI chr  X:63,104,771...63,273,934
Ensembl chr  X:63,104,771...63,273,925 		JBrowse link
G Cd46 CD46 molecule increases expression
decreases response to substance		 ISO abiraterone results in increased expression of CD46 protein
CD46 protein results in decreased susceptibility to abiraterone		 CTD PMID:30185663 NCBI chr13:106,575,586...106,606,325
Ensembl chr13:106,574,858...106,660,445 		JBrowse link
G Cyp17a1 cytochrome P450, family 17, subfamily a, polypeptide 1 decreases activity
multiple interactions		 EXP
ISO		 abiraterone results in decreased activity of CYP17A1 protein
abiraterone analog results in decreased activity of CYP17A1 protein; abiraterone results in decreased activity of CYP17A1 protein
[[abiraterone results in decreased activity of CYP17A1 protein] which results in decreased hydroxylation of Pregnenolone] which results in increased chemical synthesis of 17-alpha-Hydroxypregnenolone; [[abiraterone results in decreased activity of CYP17A1 protein] which results in decreased hydroxylation of Progesterone] which results in increased chemical synthesis of 17-alpha-Hydroxyprogesterone; [abiraterone results in decreased activity of CYP17A1 protein] which results in decreased hydroxylation of Pregnenolone; [abiraterone results in decreased activity of CYP17A1 protein] which results in decreased hydroxylation of Progesterone		 CTD PMID:17194026 PMID:25993309 PMID:29100959 NCBI chr 1:245,535,462...245,543,148
Ensembl chr 1:245,535,462...245,541,573 		JBrowse link
G Eef1a1 eukaryotic translation elongation factor 1 alpha 1 decreases expression ISO abiraterone results in decreased expression of EEF1A1 mRNA CTD PMID:27015953 NCBI chr 8:79,341,554...79,344,784
Ensembl chr 8:79,341,557...79,344,839 		JBrowse link
G F3 coagulation factor III, tissue factor increases expression ISO abiraterone results in increased expression of F3 protein CTD PMID:25569083 NCBI chr 2:209,827,061...209,838,666
Ensembl chr 2:209,826,959...209,838,668 		JBrowse link
G Tuba1a tubulin, alpha 1A decreases expression ISO abiraterone results in decreased expression of TUBA1A mRNA CTD PMID:27015953 NCBI chr 7:130,113,214...130,116,880
Ensembl chr 7:130,081,032...130,196,186 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19808
    role 19784
      application 19627
        pharmaceutical 19468
          drug 19468
            antineoplastic agent 17749
              abiraterone 6
                abiraterone acetate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19808
    subatomic particle 19806
      composite particle 19806
        hadron 19806
          baryon 19806
            nucleon 19806
              atomic nucleus 19806
                atom 19806
                  main group element atom 19756
                    p-block element atom 19756
                      carbon group element atom 19705
                        carbon atom 19702
                          organic molecular entity 19702
                            organic molecule 19655
                              organic cyclic compound 19468
                                organic polycyclic compound 17225
                                  steroid 14678
                                    hydroxy steroid 14425
                                      3-hydroxy steroid 12764
                                        3beta-hydroxy steroid 2529
                                          3beta-hydroxy-Delta(5)-steroid 2361
                                            abiraterone 6
                                              abiraterone acetate 0
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