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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:N-desmethylclozapine
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Accession:CHEBI:64050 term browser browse the term
Definition:A dibenzodoazepine substituted with chloro and piperazino groups which is a major metabolite of clozapine; a potent and selective 5-HT2C serotonin receptor antagonist.
Synonyms:exact_synonym: 8-chloro-11-(piperazin-1-yl)-5H-dibenzo[b,e][1,4]diazepine
 related_synonym: 8-Chloro-11-(1-piperazinyl)-5H-dibenzo(b,e)(1,4)diazepine;   Demethylclozapine;   Desmethylclozapine;   Formula=C17H17ClN4;   InChI=1S/C17H17ClN4/c18-12-5-6-15-16(11-12)21-17(22-9-7-19-8-10-22)13-3-1-2-4-14(13)20-15/h1-6,11,19-20H,7-10H2;   InChIKey=JNNOSTQEZICQQP-UHFFFAOYSA-N;   N-desmethyl clozapine;   NDMC;   Norclozapine;   SMILES=Clc1ccc2Nc3ccccc3C(=Nc2c1)N1CCNCC1
 xref: CAS:6104-71-8
 xref_mesh: MESH:C058272
 xref: PMID:20156258;   PMID:20463634;   PMID:21134422;   PMID:21658379;   PMID:21712711;   PMID:21726287;   PMID:21835172;   PMID:21855612;   PMID:21912901;   PMID:21917240;   Reaxys:762289;   Wikipedia:Desmethylclozapine



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N-desmethylclozapine term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Cyp1a1 cytochrome P450, family 1, subfamily a, polypeptide 1 increases chemical synthesis ISO CYP1A1 protein results in increased chemical synthesis of norclozapine CTD PMID:18809730 NCBI chr 8:58,096,021...58,102,130
Ensembl chr 8:58,096,077...58,102,125
JBrowse link
G Cyp1a2 cytochrome P450, family 1, subfamily a, polypeptide 2 multiple interactions
increases chemical synthesis
increases metabolic processing
ISO [Ciprofloxacin results in decreased activity of CYP1A2 protein] which results in increased abundance of norclozapine; Fluvoxamine inhibits the reaction [CYP1A2 protein results in increased chemical synthesis of norclozapine]
CYP1A2 protein results in increased metabolism of norclozapine
CTD PMID:11151749 PMID:12969762 PMID:18809730 NCBI chr 8:58,075,367...58,082,255
Ensembl chr 8:58,075,367...58,082,312
JBrowse link
G Cyp1b1 cytochrome P450, family 1, subfamily b, polypeptide 1 increases chemical synthesis ISO CYP1B1 protein results in increased chemical synthesis of norclozapine CTD PMID:18809730 NCBI chr 6:15,342,312...15,350,886
Ensembl chr 6:15,342,344...15,350,917
JBrowse link
G Cyp2c11 cytochrome P450, subfamily 2, polypeptide 11 increases chemical synthesis ISO CYP2C9 protein results in increased chemical synthesis of norclozapine CTD PMID:18809730 NCBI chr 1:236,762,719...236,799,069
Ensembl chr 1:236,762,842...236,799,066
JBrowse link
G Cyp2c6v1 cytochrome P450, family 2, subfamily C, polypeptide 6, variant 1 increases chemical synthesis ISO CYP2C19 protein results in increased chemical synthesis of norclozapine CTD PMID:18809730 NCBI chr 1:237,938,521...237,976,238
Ensembl chr 1:237,693,094...238,057,596
JBrowse link
G Cyp2c79 cytochrome P450, family 2, subfamily c, polypeptide 79 increases chemical synthesis ISO CYP2C8 protein results in increased chemical synthesis of norclozapine CTD PMID:18809730
G Cyp2d4 cytochrome P450, family 2, subfamily d, polypeptide 4 increases chemical synthesis ISO CYP2D6 protein results in increased chemical synthesis of norclozapine CTD PMID:18809730 NCBI chr 7:113,882,584...113,891,754
Ensembl chr 7:113,881,618...113,891,759
JBrowse link
G Cyp2j4 cytochrome P450, family 2, subfamily j, polypeptide 4 increases chemical synthesis ISO CYP2J2 protein results in increased chemical synthesis of norclozapine CTD PMID:18809730 NCBI chr 5:111,179,981...111,207,490
Ensembl chr 5:111,178,703...111,244,794
JBrowse link
G Cyp3a2 cytochrome P450, family 3, subfamily a, polypeptide 2 increases chemical synthesis
multiple interactions
ISO CYP3A4 protein results in increased chemical synthesis of norclozapine
Ketoconazole inhibits the reaction [CYP3A4 protein results in increased chemical synthesis of norclozapine]
CTD PMID:18809730 NCBI chr12:9,207,986...9,230,038
Ensembl chr12:9,015,383...9,285,008
JBrowse link
G Cyp3a9 cytochrome P450, family 3, subfamily a, polypeptide 9 increases chemical synthesis ISO CYP3A5 protein results in increased chemical synthesis of norclozapine CTD PMID:18809730 NCBI chr12:16,806,222...16,846,428
Ensembl chr12:16,806,207...16,846,422
JBrowse link
G Htr2a 5-hydroxytryptamine receptor 2A decreases expression ISO
EXP
norclozapine results in decreased expression of HTR2A mRNA
norclozapine results in decreased expression of HTR2A protein
CTD PMID:14751426 NCBI chr15:49,950,035...50,022,188
Ensembl chr15:49,950,804...50,020,928
JBrowse link

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  CHEBI ontology 19795
    role 19746
      biological role 19746
        biochemical role 19361
          metabolite 19338
            N-desmethylclozapine 11
Path 2
Term Annotations click to browse term
  CHEBI ontology 19795
    subatomic particle 19794
      composite particle 19794
        hadron 19794
          baryon 19794
            nucleon 19794
              atomic nucleus 19794
                atom 19794
                  main group element atom 19693
                    p-block element atom 19693
                      carbon group element atom 19614
                        carbon atom 19604
                          organic molecular entity 19604
                            organic molecule 19545
                              organic cyclic compound 19339
                                organic heterocyclic compound 18579
                                  organic heteropolycyclic compound 18039
                                    organic heterotricyclic compound 14640
                                      dibenzodiazepine 13
                                        N-desmethylclozapine 11
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