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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:1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazine
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Accession:CHEBI:64093 term browser browse the term
Definition:An N-alkylpiperazine that consists of piperazine bearing 2-(benzhydryloxy)ethyl and 3-phenylpropyl groups at positions 1 and 4 respectively. Potent and selective inhibitor of dopamine uptake (KD = 5.5 nM in rat striatal membranes).
Synonyms:exact_synonym: 1-[2-(diphenylmethoxy)ethyl]-4-(3-phenylpropyl)piperazine
 related_synonym: Formula=C28H34N2O;   GBR 12935;   GBR12935;   InChI=1S/C28H34N2O/c1-4-11-25(12-5-1)13-10-18-29-19-21-30(22-20-29)23-24-31-28(26-14-6-2-7-15-26)27-16-8-3-9-17-27/h1-9,11-12,14-17,28H,10,13,18-24H2;   InChIKey=RAQPOZGWANIDQT-UHFFFAOYSA-N;   SMILES=C(CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1)Cc1ccccc1
 xref: CAS:76778-22-8;   LINCS:LSM-3101
 xref_mesh: MESH:C044630
 xref: PMID:1346964;   PMID:18596684;   PMID:18784647;   PMID:19924693;   PMID:20576034;   PMID:21693154;   PMID:21741457;   PMID:21990355;   PMID:2952763;   PMID:3436357;   PMID:8007761;   PMID:9286626;   Reaxys:578614;   Wikipedia:GBR-12935
 cyclic_relationship: is_conjugate_base_of CHEBI:64092


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1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazine term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Nr3c1 nuclear receptor subfamily 3, group C, member 1 multiple interactions ISO NR3C1 protein inhibits the reaction [1-(2 (diphenylmethoxy)ethyl)-4-(3-phenylpropyl)piperazine binds to SLC6A3 protein] CTD PMID:11226678 NCBI chr18:31,271,681...31,393,320
Ensembl chr18:31,271,681...31,393,375 		JBrowse link
G Slc6a3 solute carrier family 6 member 3 affects binding
multiple interactions		 ISO
EXP		 1-(2 (diphenylmethoxy)ethyl)-4-(3-phenylpropyl)piperazine binds to SLC6A3 protein
1-(2 (diphenylmethoxy)ethyl)-4-(3-phenylpropyl)piperazine inhibits the reaction [Dextroamphetamine results in increased activity of SLC6A3 protein]; NR3C1 protein inhibits the reaction [1-(2 (diphenylmethoxy)ethyl)-4-(3-phenylpropyl)piperazine binds to SLC6A3 protein]
Paraquat inhibits the reaction [1-(2 (diphenylmethoxy)ethyl)-4-(3-phenylpropyl)piperazine binds to SLC6A3 protein]		 CTD PMID:11226678 PMID:12716422 PMID:15985715 PMID:16190885 PMID:17493592 NCBI chr 1:29,709,443...29,750,413
Ensembl chr 1:29,709,443...29,750,413 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 20089
    role 20042
      application 19781
        refrigerant 18091
          ammonia 17521
            organic amino compound 17521
              tertiary amino compound 8860
                1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazine 2
Path 2
Term Annotations click to browse term
  CHEBI ontology 20089
    subatomic particle 20058
      composite particle 20058
        hadron 20088
          baryon 20088
            nucleon 20088
              atomic nucleus 20088
                atom 20058
                  main group element atom 19960
                    main group molecular entity 19960
                      s-block molecular entity 19784
                        hydrogen molecular entity 19777
                          hydrides 19115
                            inorganic hydride 17901
                              pnictogen hydride 17884
                                nitrogen hydride 17773
                                  azane 17503
                                    ammonia 17521
                                      organic amino compound 17521
                                        tertiary amino compound 8860
                                          N-alkylpiperazine 3348
                                            1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazine 2
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