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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, sub-family C (CFTR/MRP), member 1 multiple interactions
decreases activity
ISO 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 chr16:14,361,453...14,474,878
Ensembl chr16:14,361,558...14,475,737
JBrowse link
G Abcc4 ATP-binding cassette, sub-family C (CFTR/MRP), member 4 multiple interactions
decreases activity
ISO 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 chr14:118,482,692...118,707,856
Ensembl chr14:118,482,692...118,706,219
JBrowse link
G Kcnh2 potassium voltage-gated channel, subfamily H (eag-related), member 2 multiple interactions
decreases activity
ISO 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 5:24,319,589...24,351,684
Ensembl chr 5:24,319,589...24,351,604
JBrowse link
G Ptk2b PTK2 protein tyrosine kinase 2 beta increases response to substance ISO PTK2B protein results in increased susceptibility to Mefloquine CTD PMID:21241737 NCBI chr14:66,153,257...66,281,100
Ensembl chr14:66,153,257...66,281,052
JBrowse link
G Slc22a1 solute carrier family 22 (organic cation transporter), member 1 multiple interactions ISO Mefloquine inhibits the reaction [SLC22A1 protein results in increased uptake of 1-Methyl-4-phenylpyridinium] CTD PMID:27504015 NCBI chr17:12,648,874...12,675,838
Ensembl chr17:12,648,869...12,675,829
JBrowse link
G Slc22a2 solute carrier family 22 (organic cation transporter), member 2 multiple interactions ISO Mefloquine inhibits the reaction [SLC22A2 protein results in increased uptake of 1-Methyl-4-phenylpyridinium] CTD PMID:27504015 NCBI chr17:12,584,189...12,628,489
Ensembl chr17:12,584,132...12,628,488
JBrowse link
G Slco1a4 solute carrier organic anion transporter family, member 1a4 multiple interactions ISO Mefloquine inhibits the reaction [SLCO1A2 protein results in increased uptake of estrone sulfate] CTD PMID:27504015 NCBI chr 6:141,805,438...141,856,284
Ensembl chr 6:141,805,440...141,856,199
JBrowse link
G Slco2b1 solute carrier organic anion transporter family, member 2b1 multiple interactions ISO Mefloquine affects the reaction [SLCO2B1 protein results in increased uptake of estrone sulfate] CTD PMID:27504015 NCBI chr 7:99,657,804...99,711,340
Ensembl chr 7:99,657,804...99,711,340
JBrowse link

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 21562
    role 21541
      biological role 21539
        antimicrobial agent 18334
          antimicrobial drug 6307
            antiprotozoal drug 3880
              antiplasmodial drug 2646
                antimalarial 2616
                  (-)-(11S,2'R)-erythro-mefloquine 8
                    mefloquine 8
Path 2
Term Annotations click to browse term
  CHEBI ontology 21562
    subatomic particle 21548
      composite particle 21548
        hadron 21548
          baryon 21548
            nucleon 21548
              atomic nucleus 21548
                atom 21548
                  main group element atom 21454
                    p-block element atom 21454
                      carbon group element atom 21247
                        carbon atom 21145
                          organic molecular entity 21145
                            organic molecule 21039
                              organic cyclic compound 20598
                                organic heterocyclic compound 19456
                                  organic heteromonocyclic compound 16755
                                    piperidines 7666
                                      [2,8-bis(trifluoromethyl)quinolin-4-yl]-(2-piperidyl)methanol 8
                                        (-)-(11S,2'R)-erythro-mefloquine 8
                                          mefloquine 8
paths to the root