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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:Difenacoum
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Accession:CHEBI:80743 term browser browse the term
Definition:A naphthalene that has formula C31H24O3.
Synonyms:related_synonym: Formula=C31H24O3;   InChI=1S/C31H24O3/c32-30-26-12-6-7-13-28(26)34-31(33)29(30)27-19-24(18-23-10-4-5-11-25(23)27)22-16-14-21(15-17-22)20-8-2-1-3-9-20/h1-17,24,27,32H,18-19H2;   InChIKey=FVQITOLOYMWVFU-UHFFFAOYSA-N;   SMILES=Oc1c(C2CC(Cc3ccccc23)c2ccc(cc2)-c2ccccc2)c(=O)oc2ccccc12
 xref: CAS:56073-07-5;   KEGG:C16807
 xref_mesh: MESH:C012903
 xref: PPDB:229


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Difenacoum term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Dnmt1 DNA methyltransferase 1 affects binding ISO difenacoum binds to DNMT1 protein CTD PMID:31595789 NCBI chr 8:21,922,515...21,968,495
Ensembl chr 8:21,922,515...21,968,495
JBrowse link
G Dnmt3a DNA methyltransferase 3 alpha affects binding ISO difenacoum binds to DNMT3A protein CTD PMID:31595789 NCBI chr 6:28,205,375...28,346,052
Ensembl chr 6:28,235,695...28,340,577
JBrowse link
G Vkorc1 vitamin K epoxide reductase complex, subunit 1 decreases response to substance ISO
EXP
VKORC1 protein polymorphism results in decreased susceptibility to difenacoum
VKORC1 protein mutant form results in decreased susceptibility to difenacoum; VKORC1 protein polymorphism results in decreased susceptibility to difenacoum
CTD PMID:27117082 PMID:29155484 NCBI chr 1:199,338,785...199,341,306
Ensembl chr 1:199,337,138...199,341,302
JBrowse link

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19841
    chemical entity 19841
      molecular entity 19839
        polyatomic entity 19754
          molecule 19587
            cyclic compound 19404
              ring assembly 7204
                Difenacoum 3
Path 2
Term Annotations click to browse term
  CHEBI ontology 19841
    subatomic particle 19839
      composite particle 19839
        hadron 19839
          baryon 19839
            nucleon 19839
              atomic nucleus 19839
                atom 19839
                  main group element atom 19732
                    p-block element atom 19732
                      carbon group element atom 19636
                        carbon atom 19625
                          organic molecular entity 19625
                            organic molecule 19556
                              organic cyclic compound 19365
                                carbocyclic compound 18273
                                  carbopolycyclic compound 16980
                                    carbobicyclic compound 4576
                                      naphthalenes 3755
                                        Difenacoum 3
paths to the root