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: isophorone diisocyanate
Accession: CHEBI:53214
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Definition: A diisocyanate in which the two isocyanate groups are linked by an isophorone substituent.
Synonyms: exact_synonym: 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane
related_synonym: 3-Isocyanatomethyl-3,5,5-trimethylcyclohexylisocyanate; Formula=C12H18N2O2; IPDI; InChI=1S/C12H18N2O2/c1-11(2)4-10(14-9-16)5-12(3,6-11)7-13-8-15/h10H,4-7H2,1-3H3; InChIKey=NIMLQBUJDJZYEJ-UHFFFAOYSA-N; Isocyanic acid, methylene(3,5,5-trimethyl-3,1-cyclohexylene) ester; Isophorone diamine diisocyanate; SMILES=CC1(C)CC(CC(C)(CN=C=O)C1)N=C=O
xref: CAS:4098-71-9
xref_mesh: MESH:C015301
xref: PMID:1447476; PMID:19851844; PMID:20817708; PMID:22237013; PMID:23218325; PMID:23394610; PMID:23484438; PMID:23548862; PMID:23564646; PMID:23648023; Wikipedia:Isophorone_diisocyanate
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CXCL8
C-X-C motif chemokine ligand 8
increases expression multiple interactions
EXP
isophorone diisocyanate results in increased expression of CXCL8 mRNA [isophorone diisocyanate co-treated with lipopolysaccharide, E. coli O26-B6] results in decreased expression of CXCL8 mRNA
CTD
PMID:29594315
NCBI chr 4:73,740,569...73,743,716
Ensembl chr 4:73,740,519...73,743,716
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IL10
interleukin 10
increases expression
ISO
isophorone diisocyanate results in increased expression of IL10 protein
CTD
PMID:19422874
NCBI chr 1:206,767,602...206,772,494
Ensembl chr 1:206,767,602...206,774,541
G
IL13
interleukin 13
increases secretion
ISO
isophorone diisocyanate results in increased secretion of IL13 protein
CTD
PMID:17693426
NCBI chr 5:132,656,522...132,661,110
Ensembl chr 5:132,656,263...132,661,110
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IL1B
interleukin 1 beta
decreases expression
EXP
isophorone diisocyanate results in decreased expression of IL1B mRNA
CTD
PMID:29594315
NCBI chr 2:112,829,751...112,836,779
Ensembl chr 2:112,829,751...112,836,816
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IL2
interleukin 2
multiple interactions
EXP
[isophorone diisocyanate co-treated with Ionomycin co-treated with Tetradecanoylphorbol Acetate] results in decreased expression of IL2 mRNA
CTD
PMID:29594315
NCBI chr 4:122,451,470...122,456,725
Ensembl chr 4:122,451,470...122,456,725
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IL4
interleukin 4
increases expression increases secretion
ISO
isophorone diisocyanate results in increased expression of IL4 protein isophorone diisocyanate results in increased secretion of IL4 protein
CTD
PMID:17693426 PMID:19422874
NCBI chr 5:132,673,989...132,682,678
Ensembl chr 5:132,673,986...132,682,678
G
NFE2L2
NFE2 like bZIP transcription factor 2
affects response to substance
ISO
NFE2L2 affects the susceptibility to isophorone diisocyanate
CTD
PMID:23564646
NCBI chr 2:177,230,303...177,264,727
Ensembl chr 2:177,218,667...177,392,756
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