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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:dorsomorphin
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Accession:CHEBI:78510 term browser browse the term
Definition:A pyrazolopyrimidine that is pyrazolo[1,5-a]pyrimidine which is substituted at positions 3 and 6 by pyridin-4-yl and p-[2-(piperidin-1-yl)ethoxy]phenyl groups, respectively. It is a potent, selective, reversible, and ATP-competitive inhibitor of AMPK (AMP-activated protein kinase, EC 2.7.11.31) and a selective inhibitor of bone morphogenetic protein (BMP) signaling.
Synonyms:exact_synonym: 6-{4-[2-(piperidin-1-yl)ethoxy]phenyl}-3-(pyridin-4-yl)pyrazolo[1,5-a]pyrimidine
 related_synonym: Formula=C24H25N5O;   InChI=1S/C24H25N5O/c1-2-12-28(13-3-1)14-15-30-22-6-4-19(5-7-22)21-16-26-24-23(17-27-29(24)18-21)20-8-10-25-11-9-20/h4-11,16-18H,1-3,12-15H2;   InChIKey=XHBVYDAKJHETMP-UHFFFAOYSA-N;   SMILES=C(CN1CCCCC1)Oc1ccc(cc1)-c1cnc2c(cnn2c1)-c1ccncc1;   compound C
 alt_id: MESH:C516138
 xref: CAS:866405-64-3;   DrugBank:DB08597;   LINCS:LSM-3207
 xref_mesh: MESH:C516138
 xref: PDBeChem:TAK;   PMID:18026094;   PMID:18682835;   PMID:19996563;   PMID:20691279;   PMID:21384475;   PMID:21543851;   PMID:21988724;   PMID:23526253;   PMID:23936500;   PMID:24280125;   PMID:24396733;   PMID:35782765;   PMID:38500971;   Reaxys:11725482



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    Path 1
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      CHEBI ontology 19899
        role 19870
          biological role 19868
            pharmacological role 19105
              antagonist 17268
                bone morphogenetic protein receptor antagonist 5703
                  dorsomorphin 5703
    Path 2
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      CHEBI ontology 19899
        subatomic particle 19897
          composite particle 19897
            hadron 19897
              baryon 19897
                nucleon 19897
                  atomic nucleus 19897
                    atom 19897
                      main group element atom 19836
                        p-block element atom 19836
                          carbon group element atom 19776
                            carbon atom 19772
                              organic molecular entity 19772
                                organic molecule 19725
                                  organic cyclic compound 19517
                                    organic heterocyclic compound 18894
                                      organic heteropolycyclic compound 18322
                                        organic heterobicyclic compound 17272
                                          pyrazolopyrimidine 5755
                                            dorsomorphin 5703
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