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: 2,2'-(1-phenyl-1H-1,2,4-triazole-3,5-diyl)diphenol
Accession: CHEBI:855
browse the term
Definition: A member of the class of triazoles that is 1-phenyl-1H-1,2,4-triazole substituted by 2-hydroxyphenyl groups at positions 3 and 5.
Synonyms: related_synonym: 2,2'-(1-phenyl-1H-1,2,4-triazole-3,5-diyl)bis-phenol; 3,5-bis(2-hydroxyphenyl)-1-phenyl-1H-1,2,4-triazole; Formula=C20H15N3O2; InChI=1S/C20H15N3O2/c24-17-12-6-4-10-15(17)19-21-20(16-11-5-7-13-18(16)25)23(22-19)14-8-2-1-3-9-14/h1-13,24-25H; InChIKey=ZSVXKCSZMLMPBW-UHFFFAOYSA-N; SMILES=Oc1ccccc1-c1nc(-c2ccccc2O)n(n1)-c1ccccc1; decarboxydeferasirox
xref: KEGG:C11569; Reaxys:4541552
G
Casp3
caspase 3
increases expression increases activity
ISO
deferasirox results in increased expression of CASP3 protein deferasirox results in increased activity of CASP3 protein
CTD
PMID:21439361
NCBI chr16:45,662,910...45,681,171
Ensembl chr16:45,662,910...45,684,648
G
Ccnt1
cyclin T1
multiple interactions
ISO
deferasirox inhibits the reaction [CDK9 protein binds to CCNT1 protein]
CTD
PMID:17631934
NCBI chr 7:129,687,146...129,718,080
Ensembl chr 7:129,691,209...129,717,871
G
Cdk2
cyclin dependent kinase 2
decreases activity
ISO
deferasirox results in decreased activity of CDK2 protein
CTD
PMID:17631934
NCBI chr 7:1,129,878...1,137,431
Ensembl chr 7:1,129,811...1,137,403
G
Cdk9
cyclin-dependent kinase 9
multiple interactions
ISO
deferasirox inhibits the reaction [CDK9 protein binds to CCNT1 protein]
CTD
PMID:17631934
NCBI chr 3:15,996,467...16,001,315
Ensembl chr 3:15,996,468...16,002,410
G
Clu
clusterin
increases expression
EXP
deferasirox results in increased expression of CLU protein
CTD
PMID:21439361
NCBI chr15:40,161,068...40,200,315
Ensembl chr15:40,174,617...40,200,315
G
Havcr1
hepatitis A virus cellular receptor 1
increases expression
ISO EXP
deferasirox results in increased expression of HAVCR1 protein
CTD
PMID:21439361
NCBI chr10:31,118,667...31,151,730
Ensembl chr10:31,119,088...31,151,698
G
Lcn2
lipocalin 2
increases expression
ISO EXP
deferasirox results in increased expression of LCN2 protein
CTD
PMID:21439361
NCBI chr 3:15,680,688...15,684,033
Ensembl chr 3:15,680,687...15,684,095
G
Polr2a
RNA polymerase II subunit A
decreases phosphorylation
ISO
deferasirox results in decreased phosphorylation of POLR2A protein
CTD
PMID:17631934
NCBI chr10:54,452,438...54,478,486
Ensembl chr10:54,452,441...54,478,455
Term paths to the root one shortest all shortest one longest all longest one shortest and longest all
Path 1
CHEBI ontology
19880
chemical entity
19878
molecular entity
19878
polyatomic entity
19830
heteroatomic molecular entity
19787
hydroxides
19347
organic hydroxy compound
18957
phenols
18655
2,2'-(1-phenyl-1H-1,2,4-triazole-3,5-diyl)diphenol
8
deferasirox
8
Path 2
CHEBI ontology
19880
subatomic particle
19878
composite particle
19878
hadron
19878
baryon
19878
nucleon
19878
atomic nucleus
19878
atom
19878
main group element atom
19817
p-block element atom
19817
carbon group element atom
19757
carbon atom
19754
organic molecular entity
19754
organic molecule
19706
organic cyclic compound
19495
organic heterocyclic compound
18874
heteroarene
17155
monocyclic heteroarene
14983
azole
14506
triazoles
8421
1-phenyl-1H-1,2,4-triazole
15
2,2'-(1-phenyl-1H-1,2,4-triazole-3,5-diyl)diphenol
8
deferasirox
8