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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:(-)-(11S,2'R)-erythro-mefloquine
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Accession:CHEBI:63687 term browser browse the term
Definition:An optically active form of [2,8-bis(trifluoromethyl)quinolin-4-yl]-(2-piperidyl)methanol having (-)-(11S,2'R)-erythro-configuration. An antimalarial agent, used in racemic form, which acts as a blood schizonticide; its mechanism of action is unknown.
Synonyms:exact_synonym: (S)-[2,8-bis(trifluoromethyl)quinolin-4-yl][(2R)-piperidin-2-yl]methanol
 related_synonym: (-)-Mefloquine;   Formula=C17H16F6N2O;   InChI=1S/C17H16F6N2O/c18-16(19,20)11-5-3-4-9-10(15(26)12-6-1-2-7-24-12)8-13(17(21,22)23)25-14(9)11/h3-5,8,12,15,24,26H,1-2,6-7H2/t12-,15+/m1/s1;   InChIKey=XEEQGYMUWCZPDN-DOMZBBRYSA-N;   SMILES=O[C@H]([C@H]1CCCCN1)c1cc(nc2c(cccc12)C(F)(F)F)C(F)(F)F;   [(11S,2'R)-2,8-bis(trifluoromethyl)quinolin-4-yl]-(2-piperidyl)methanol
 xref: CAS:51742-87-1;   LINCS:LSM-5525;   Reaxys:5629059
 cyclic_relationship: is_enantiomer_of CHEBI:63684


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mefloquine term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G ABCC1 ATP binding cassette subfamily C member 1 multiple interactions
decreases activity
EXP Mefloquine inhibits the reaction [ABCC1 protein affects the export of fluorexon]; Mefloquine inhibits the reaction [ABCC1 protein affects the transport of S-(2,4-dinitrophenyl)glutathione]; Mefloquine inhibits the reaction [Prostaglandins E results in increased activity of ABCC1 protein]; Mefloquine inhibits the reaction [Quercetin results in increased activity of ABCC1 protein]
Mefloquine results in decreased activity of ABCC1 protein
CTD PMID:16004972 NCBI chr16:15,949,616...16,143,062
Ensembl chr16:15,949,577...16,143,074
Ensembl chr16:15,949,577...16,143,074
JBrowse link
G ABCC4 ATP binding cassette subfamily C member 4 multiple interactions
decreases activity
EXP Mefloquine inhibits the reaction [ABCC4 protein affects the export of 2',7'-bis(carboxyethyl)-5(6)-carboxyfluorescein]; Mefloquine inhibits the reaction [Prostaglandins E results in increased activity of ABCC4 protein]; Mefloquine inhibits the reaction [Quercetin results in increased activity of ABCC4 protein]
Mefloquine results in decreased activity of ABCC4 protein
CTD PMID:16004972 NCBI chr13:95,019,835...95,301,451
Ensembl chr13:95,019,835...95,301,475
JBrowse link
G CYP3A4 cytochrome P450 family 3 subfamily A member 4 multiple interactions EXP Ketoconazole inhibits the reaction [CYP3A4 protein affects the metabolism of Mefloquine] CTD PMID:15896247 NCBI chr 7:99,756,967...99,784,184
Ensembl chr 7:99,756,960...99,784,248
JBrowse link
G KCNH2 potassium voltage-gated channel subfamily H member 2 multiple interactions
decreases activity
EXP Mefloquine inhibits the reaction [KCNH2 protein results in increased transport of Thallium]
Mefloquine results in decreased activity of KCNH2 protein
CTD PMID:21158687 PMID:28551711 NCBI chr 7:150,944,956...150,978,321
Ensembl chr 7:150,944,961...150,978,321
JBrowse link
G PTK2B protein tyrosine kinase 2 beta increases response to substance ISO PTK2B protein results in increased susceptibility to Mefloquine CTD PMID:21241737 NCBI chr 8:27,311,478...27,459,391
Ensembl chr 8:27,311,482...27,459,391
JBrowse link
G SLC22A1 solute carrier family 22 member 1 multiple interactions EXP Mefloquine inhibits the reaction [SLC22A1 protein results in increased uptake of 1-Methyl-4-phenylpyridinium] CTD PMID:27504015 NCBI chr 6:160,121,808...160,160,590
Ensembl chr 6:160,121,815...160,158,718
JBrowse link
G SLC22A2 solute carrier family 22 member 2 multiple interactions EXP Mefloquine inhibits the reaction [SLC22A2 protein results in increased uptake of 1-Methyl-4-phenylpyridinium] CTD PMID:27504015 NCBI chr 6:160,216,755...160,258,821
Ensembl chr 6:160,171,061...160,277,638
JBrowse link
G SLCO1A2 solute carrier organic anion transporter family member 1A2 multiple interactions EXP Mefloquine inhibits the reaction [SLCO1A2 protein results in increased uptake of estrone sulfate] CTD PMID:27504015 NCBI chr12:21,264,600...21,419,634
Ensembl chr12:21,264,600...21,419,594
JBrowse link
G SLCO2B1 solute carrier organic anion transporter family member 2B1 multiple interactions EXP Mefloquine affects the reaction [SLCO2B1 protein results in increased uptake of estrone sulfate] CTD PMID:27504015 NCBI chr11:75,151,107...75,206,549
Ensembl chr11:75,100,563...75,206,549
JBrowse link

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 24386
    role 24296
      biological role 24263
        antimicrobial agent 20555
          antimicrobial drug 6522
            antiprotozoal drug 4112
              antiplasmodial drug 2859
                antimalarial 2829
                  (-)-(11S,2'R)-erythro-mefloquine 9
                    mefloquine 9
Path 2
Term Annotations click to browse term
  CHEBI ontology 24386
    subatomic particle 24343
      composite particle 24343
        hadron 24343
          baryon 24343
            nucleon 24343
              atomic nucleus 24343
                atom 24343
                  main group element atom 24190
                    p-block element atom 24190
                      carbon group element atom 23972
                        carbon atom 23933
                          organic molecular entity 23933
                            organic molecule 23815
                              organic cyclic compound 23100
                                organic heterocyclic compound 21235
                                  organic heteromonocyclic compound 17539
                                    piperidines 8028
                                      [2,8-bis(trifluoromethyl)quinolin-4-yl]-(2-piperidyl)methanol 9
                                        (-)-(11S,2'R)-erythro-mefloquine 9
                                          mefloquine 9
paths to the root