메뉴 건너뛰기




Volumn 72, Issue , 2013, Pages 282-290

Identification of an allosteric modulator of the serotonin transporter with novel mechanism of action

Author keywords

Allosteric modulator; Hybrid structure based method; Molecular dynamics; Monoamine transporters; Psychostimulants; Virtual screening

Indexed keywords

3,4 METHYLENEDIOXYMETHAMPHETAMINE; ATM 7; SEROTONIN RECEPTOR AFFECTING AGENT; SEROTONIN TRANSPORTER; UNCLASSIFIED DRUG;

EID: 84881168900     PISSN: 00283908     EISSN: 18737064     Source Type: Journal    
DOI: 10.1016/j.neuropharm.2013.04.026     Document Type: Article
Times cited : (32)

References (56)
  • 1
    • 0041353145 scopus 로고    scopus 로고
    • Structure and mechanism of the lactose permease of Escherichia coli
    • DOI 10.1126/science.1088196
    • Abramson, J., Smirnova, I., Kasho, V., Verner, G., Kaback, H.R., Iwata, S., 2003. Structure and mechanism of the lactose permease of Escherichia coli. Science 301, 610-615. (Pubitemid 36927939)
    • (2003) Science , vol.301 , Issue.5633 , pp. 610-615
    • Abramson, J.1    Smirnova, I.2    Kasho, V.3    Verner, G.4    Kaback, H.R.5    Iwata, S.6
  • 3
    • 0032970989 scopus 로고    scopus 로고
    • A review of central 5-HT receptors and their function
    • DOI 10.1016/S0028-3908(99)00010-6, PII S0028390899000106
    • Barnes, N.M., Sharp, T., 1999. A review of central 5-HT receptors and their function. Neuropharmacology 38, 1083-1152. (Pubitemid 29292403)
    • (1999) Neuropharmacology , vol.38 , Issue.8 , pp. 1083-1152
    • Barnes, N.M.1    Sharp, T.2
  • 6
    • 34547139405 scopus 로고    scopus 로고
    • The midpoint method for parallelization of particle simulations
    • Bowers, K.J., Dror, R.O., Shaw, D.E., 2006. The midpoint method for parallelization of particle simulations. J. Chem. Phys. 124, 184109.
    • (2006) J. Chem. Phys. , vol.124 , pp. 184109
    • Bowers, K.J.1    Dror, R.O.2    Shaw, D.E.3
  • 7
    • 33947249313 scopus 로고    scopus 로고
    • Tianeptine: A novel atypical antidepressant that may provide new insights into the biomolecular basis of depression
    • Brink, C.B., Harvey, B.H., Brand, L., 2006. Tianeptine: a novel atypical antidepressant that may provide new insights into the biomolecular basis of depression. Recent Pat. CNS Drug Discov. 1, 29-41.
    • (2006) Recent Pat. CNS Drug Discov. , vol.1 , pp. 29-41
    • Brink, C.B.1    Harvey, B.H.2    Brand, L.3
  • 8
    • 0032190185 scopus 로고    scopus 로고
    • Amino acid residues that control pH modulation of transport-associated current in mammalian serotonin transporters
    • Cao, Y., Li, M., Mager, S., Lester, H.A., 1998. Amino acid residues that control pH modulation of transport-associated current in mammalian serotonin transporters. J. Neurosci. 18, 7739-7779.
    • (1998) J. Neurosci. , vol.18 , pp. 7739-7779
    • Cao, Y.1    Li, M.2    Mager, S.3    Lester, H.A.4
  • 12
    • 0031226772 scopus 로고    scopus 로고
    • Empirical scoring functions: I. The development of a fast empirical scoring function to estimate the binding affinity of ligands in receptor complexes
    • Eldridge, M.D., Murray, C.W., Auton, T.R., Paolini, G.V., Mee, R.P., 1997. Empirical scoring functions: I. The development of a fast empirical scoring function to estimate the binding affinity of ligands in receptor complexes. J. Comput. Aided Mol. Des. 11, 425-445. (Pubitemid 127505895)
    • (1997) Journal of Computer-Aided Molecular Design , vol.11 , Issue.5 , pp. 425-445
    • Eldridge, M.D.1    Murray, C.W.2    Auton, T.R.3    Paolini, G.V.4    Mee, R.P.5
  • 13
    • 0025063939 scopus 로고
    • Tianeptine stimulates uptake of 5-hydroxytryptamine in vivo in the rat brain
    • DOI 10.1016/0028-3908(90)90076-4
    • Fattaccini, C.M., Bolaños-Jimenez, F., Gozlan, H., Hamon, M., 1990. Tianeptine stimulates uptake of 5-hydroxytryptamine in vivo in the rat brain. Neuropharmacology 29, 1-8. (Pubitemid 20027385)
    • (1990) Neuropharmacology , vol.29 , Issue.1 , pp. 1-8
    • Fattaccini, C.M.1    Bolanos-Jimenez, F.2    Gozlan, H.3    Hamon, M.4
  • 18
    • 0028854034 scopus 로고
    • Molecular recognition of receptor sites using a genetic algorithm with a description of desolvation
    • Jones, G., Willett, P., Glen, R.C., 1995. Molecular recognition of receptor sites using a genetic algorithm with a description of desolvation. J. Mol. Biol. 245, 43-53.
    • (1995) J. Mol. Biol. , vol.245 , pp. 43-53
    • Jones, G.1    Willett, P.2    Glen, R.C.3
  • 19
    • 0032052278 scopus 로고    scopus 로고
    • An improved PCR-mutagenesis strategy for two-site mutagenesis or sequence swapping between related genes
    • DOI 10.1093/nar/26.7.1848
    • Kirsch, R.D., Joly, E., 1998. An improved PCR-mutagenesis strategy for two-site mutagenesis or sequence swapping between related genes. Nucleic Acids Res. 26, 1848-1850. (Pubitemid 28291826)
    • (1998) Nucleic Acids Research , vol.26 , Issue.7 , pp. 1848-1850
    • Kirsch, R.D.1    Joly, E.2
  • 20
    • 0026722234 scopus 로고
    • Dopamine transporter site-directed mutations differentially alter substrate transport and cocaine binding
    • Kitayama, S., Shimada, S., Xu, H., Markham, L., Donovan, D.M., Uhl, G.R., 1992. Dopamine transporter site-directed mutations differentially alter substrate transport and cocaine binding. Proc. Natl. Acad. Sci. U. S. A. 89, 7782-7785.
    • (1992) Proc. Natl. Acad. Sci. U. S. A. , vol.89 , pp. 7782-7785
    • Kitayama, S.1    Shimada, S.2    Xu, H.3    Markham, L.4    Donovan, D.M.5    Uhl, G.R.6
  • 21
    • 84870207672 scopus 로고    scopus 로고
    • Screening for small molecule inhibitors of Toxoplasma gondii
    • Kortagere, S., 2012. Screening for small molecule inhibitors of Toxoplasma gondii. Expert Opin. Drug Discov. 7, 1193-1206.
    • (2012) Expert Opin. Drug Discov. , vol.7 , pp. 1193-1206
    • Kortagere, S.1
  • 22
    • 61349196018 scopus 로고    scopus 로고
    • Hybrid scoring and classification approaches to predict human pregnane X receptor activators
    • Kortagere, S., Chekmarev, D., Welsh, W.J., Ekins, S., 2009. Hybrid scoring and classification approaches to predict human pregnane X receptor activators. Pharm. Res. 26, 1001-1011.
    • (2009) Pharm. Res. , vol.26 , pp. 1001-1011
    • Kortagere, S.1    Chekmarev, D.2    Welsh, W.J.3    Ekins, S.4
  • 23
    • 46749128531 scopus 로고    scopus 로고
    • New predictive models for bloodebrain barrier permeability of drug-like molecules
    • Kortagere, S., Chekmarev, D., Welsh, W.J., Ekins, S., 2008. New predictive models for bloodebrain barrier permeability of drug-like molecules. Pharm. Res. 25, 1836-1845.
    • (2008) Pharm. Res. , vol.25 , pp. 1836-1845
    • Kortagere, S.1    Chekmarev, D.2    Welsh, W.J.3    Ekins, S.4
  • 24
    • 84934443700 scopus 로고    scopus 로고
    • Ligand- and structure-based pregnane X receptor models
    • Kortagere, S., Krasowski, M.D., Ekins, S., 2012a. Ligand- and structure-based pregnane X receptor models. Methods Mol. Biol. 929, 359-375.
    • (2012) Methods Mol. Biol. , vol.929 , pp. 359-375
    • Kortagere, S.1    Krasowski, M.D.2    Ekins, S.3
  • 26
    • 80051706045 scopus 로고    scopus 로고
    • Rapid discovery of inhibitors of Toxoplasma gondii using hybrid structure-based computational approach
    • Kortagere, S., Mui, E., McLeod, R., Welsh, W.J., 2011. Rapid discovery of inhibitors of Toxoplasma gondii using hybrid structure-based computational approach. J. Comput. Aided Mol. Des. 25, 403-411.
    • (2011) J. Comput. Aided Mol. Des. , vol.25 , pp. 403-411
    • Kortagere, S.1    Mui, E.2    McLeod, R.3    Welsh, W.J.4
  • 27
    • 33947581421 scopus 로고    scopus 로고
    • Development and application of hybrid structure based method for efficient screening of ligands binding to G-protein coupled receptors
    • DOI 10.1007/s10822-006-9077-8, Advances in Phatmacophores and 3-D Screening
    • Kortagere, S., Welsh, W.J., 2006. Development and application of hybrid structure based method for efficient screening of ligands binding to G-protein coupled receptors. J. Comput. Aided Mol. Des. 20, 789-802. (Pubitemid 46476947)
    • (2006) Journal of Computer-Aided Molecular Design , vol.20 , Issue.12 , pp. 789-802
    • Kortagere, S.1    Welsh, W.J.2
  • 29
    • 84856225222 scopus 로고    scopus 로고
    • X-ray structures of LeuT in substrate-free outward-open and apo inward-open states
    • Krishnamurthy, H., Gouaux, E., 2012. X-ray structures of LeuT in substrate-free outward-open and apo inward-open states. Nature 481, 469-474.
    • (2012) Nature , vol.481 , pp. 469-474
    • Krishnamurthy, H.1    Gouaux, E.2
  • 31
    • 84864463916 scopus 로고    scopus 로고
    • Identification and characterization of a novel class of atypical dopamine receptor agonists
    • Kuzhikandathil, E.V., Kortagere, S., 2012. Identification and characterization of a novel class of atypical dopamine receptor agonists. Pharm. Res. 29, 2264-2275.
    • (2012) Pharm. Res. , vol.29 , pp. 2264-2275
    • Kuzhikandathil, E.V.1    Kortagere, S.2
  • 32
    • 79955769299 scopus 로고    scopus 로고
    • Dopamine transport by the serotonin transporter: A mechanistically distinct mode of substrate translocation
    • Larsen, M.B., Sonders, M.S., Mortensen, O.V., Larson, G.A., Zahniser, N.R., Amara, S.G., 2011. Dopamine transport by the serotonin transporter: a mechanistically distinct mode of substrate translocation. J. Neurosci. 31, 6605-6615.
    • (2011) J. Neurosci. , vol.31 , pp. 6605-6615
    • Larsen, M.B.1    Sonders, M.S.2    Mortensen, O.V.3    Larson, G.A.4    Zahniser, N.R.5    Amara, S.G.6
  • 33
    • 0035289779 scopus 로고    scopus 로고
    • Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings
    • DOI 10.1016/S0169-409X(00)00129-0, PII S0169409X00001290
    • Lipinski, C.A., Lombardo, F., Dominy, B.W., Feeney, P.J., 2001. Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings. Adv. Drug Deliv. Rev. 46, 3-26. (Pubitemid 33653411)
    • (2000) Advanced Drug Delivery Reviews , vol.46 , Issue.1-3 , pp. 3-26
    • Lipinski, C.A.1    Lombardo, F.2    Dominy, B.W.3    Feeney, P.J.4
  • 34
    • 84861060898 scopus 로고    scopus 로고
    • OPM database and PPM web server: Resources for positioning of proteins in membranes
    • Lomize, M.A., Pogozheva, I.D., Joo, H., Mosberg, H.I., Lomize, A.L., 2012. OPM database and PPM web server: resources for positioning of proteins in membranes. Nucleic Acids Res. 40, D370eD376.
    • (2012) Nucleic Acids Res. , vol.40
    • Lomize, M.A.1    Pogozheva, I.D.2    Joo, H.3    Mosberg, H.I.4    Lomize, A.L.5
  • 35
    • 84869124607 scopus 로고    scopus 로고
    • Monoamine transporter structure, function, dynamics, and drug discovery: A computational perspective
    • Manepalli, S., Surratt, C.K., Madura, J.D., Nolan, T.L., 2012. Monoamine transporter structure, function, dynamics, and drug discovery: a computational perspective. AAPS J. 14, 820-831.
    • (2012) AAPS J. , vol.14 , pp. 820-831
    • Manepalli, S.1    Surratt, C.K.2    Madura, J.D.3    Nolan, T.L.4
  • 36
    • 77249090207 scopus 로고    scopus 로고
    • The neurobiological properties of tianeptine (Stablon): From monoamine hypothesis to glutamatergic modulation
    • McEwen, B.S., Chattarji, S., Diamond, D.M., Jay, T.M., Reagan, L.P., Svenningsson, P., Fuchs, E., 2010. The neurobiological properties of tianeptine (Stablon): from monoamine hypothesis to glutamatergic modulation. Mol. Psychiatry 15, 237-249.
    • (2010) Mol. Psychiatry , vol.15 , pp. 237-249
    • McEwen, B.S.1    Chattarji, S.2    Diamond, D.M.3    Jay, T.M.4    Reagan, L.P.5    Svenningsson, P.6    Fuchs, E.7
  • 37
    • 84869422392 scopus 로고    scopus 로고
    • Serotonin and emotion, learning and memory
    • Meneses, A., Liy-Salmeron, G., 2012. Serotonin and emotion, learning and memory. Rev. Neurosci.. http://dx.doi.org/10.1515/revneuro-2012-0060.
    • (2012) Rev. Neurosci
    • Meneses, A.1    Liy-Salmeron, G.2
  • 39
    • 44849104847 scopus 로고    scopus 로고
    • Serotonin receptors
    • DOI 10.1021/cr078224o
    • Nichols, D.E., Nichols, C.D., 2008. Serotonin receptors. Chem. Rev. 108, 1614-1641. (Pubitemid 351796401)
    • (2008) Chemical Reviews , vol.108 , Issue.5 , pp. 1614-1641
    • Nichols, D.E.1    Nichols, C.D.2
  • 41
    • 84873952800 scopus 로고    scopus 로고
    • Steric hindrance mutagenesis in the conserved extracellular vestibule impedes allosteric binding of antidepressants to the serotonin transporter
    • Plenge, P., Shi, L., Beuming, T., Te, J., Newman, A.H., Weinstein, H., Gether, U., Loland, C.J., 2012. Steric hindrance mutagenesis in the conserved extracellular vestibule impedes allosteric binding of antidepressants to the serotonin transporter. J. Biol. Chem. 287, 39316-39326.
    • (2012) J. Biol. Chem. , vol.287 , pp. 39316-39326
    • Plenge, P.1    Shi, L.2    Beuming, T.3    Te, J.4    Newman, A.H.5    Weinstein, H.6    Gether, U.7    Loland, C.J.8
  • 43
    • 28844506362 scopus 로고    scopus 로고
    • Putative drug binding conformations of monoamine transporters
    • DOI 10.1016/j.bmc.2005.08.054, PII S0968089605008254
    • Ravna, A.W., Sylte, I., Kristiansen, K., Dahl, S.G., 2006. Putative drug binding conformations of monoamine transporters. Bioorg. Med. Chem. 14, 666-675. (Pubitemid 41767571)
    • (2006) Bioorganic and Medicinal Chemistry , vol.14 , Issue.3 , pp. 666-675
    • Ravna, A.W.1    Sylte, I.2    Kristiansen, K.3    Dahl, S.G.4
  • 44
    • 34247233255 scopus 로고    scopus 로고
    • Serotonin transporters e structure and function
    • Rudnick, G., 2006. Serotonin transporters e structure and function. J. Membr. Biol. 213, 101-110.
    • (2006) J. Membr. Biol. , vol.213 , pp. 101-110
    • Rudnick, G.1
  • 46
    • 58149233796 scopus 로고    scopus 로고
    • A competitive inhibitor traps LeuT in an open-to-out conformation
    • Singh, S.K., Piscitelli, C.L., Yamashita, A., Gouaux, E., 2008. A competitive inhibitor traps LeuT in an open-to-out conformation. Science 322, 1655-1661.
    • (2008) Science , vol.322 , pp. 1655-1661
    • Singh, S.K.1    Piscitelli, C.L.2    Yamashita, A.3    Gouaux, E.4
  • 47
    • 34548178234 scopus 로고    scopus 로고
    • Antidepressant binding site in a bacterial homologue of neurotransmitter transporters
    • DOI 10.1038/nature06038, PII NATURE06038
    • Singh, S.K., Yamashita, A., Gouaux, E., 2007. Antidepressant binding site in a bacterial homologue of neurotransmitter transporters. Nature 448, 952-956. (Pubitemid 47312772)
    • (2007) Nature , vol.448 , Issue.7156 , pp. 952-956
    • Singh, S.K.1    Yamashita, A.2    Gouaux, E.3
  • 49
    • 20644441994 scopus 로고    scopus 로고
    • Mechanisms of neurotransmitter release by amphetamines: A review
    • DOI 10.1016/j.pneurobio.2005.04.003, PII S0301008205000432
    • Sulzer, D., Sonders, M.S., Poulsen, N.W., Galli, A., 2005. Mechanisms of neurotransmitter release by amphetamines: a review. Prog. Neurobiol. 75, 406-433. (Pubitemid 40834286)
    • (2005) Progress in Neurobiology , vol.75 , Issue.6 , pp. 406-433
    • Sulzer, D.1    Sonders, M.S.2    Poulsen, N.W.3    Galli, A.4
  • 50
    • 0037264650 scopus 로고    scopus 로고
    • Plasma membrane monoamine transporters: Structure, regulation and function
    • DOI 10.1038/nrn1008
    • Torres, G.E., Gainetdinov, R.R., Caron, M.G., 2003. Plasma membrane monoamine transporters: structure, regulation and function. Nat. Rev. Neurosci. 4, 13-25. (Pubitemid 37271085)
    • (2003) Nature Reviews Neuroscience , vol.4 , Issue.1 , pp. 13-25
    • Torres, G.E.1    Gainetdinov, R.R.2    Caron, M.G.3
  • 51
    • 77952029377 scopus 로고    scopus 로고
    • Structural analysis of the extracellular entrance to the serotonin transporter permeation pathway
    • Torres-Altoro, M.I., Kuntz, C.P., Nichols, D.E., Barker, E.L., 2010. Structural analysis of the extracellular entrance to the serotonin transporter permeation pathway. J. Biol. Chem. 285, 15369-15379.
    • (2010) J. Biol. Chem. , vol.285 , pp. 15369-15379
    • Torres-Altoro, M.I.1    Kuntz, C.P.2    Nichols, D.E.3    Barker, E.L.4
  • 52
    • 0037302791 scopus 로고    scopus 로고
    • Role of selective serotonin reuptake inhibitors in psychiatric disorders: A comprehensive review
    • DOI 10.1016/S0278-5846(02)00338-X, PII S027858460200338X
    • Vaswani, M., Linda, F.K., Ramesh, S., 2003. Role of selective serotonin reuptake inhibitors in psychiatric disorders: a comprehensive review. Prog. Neuropsychopharmacol. Biol. Psychiatry 27, 85-102. (Pubitemid 36131110)
    • (2003) Progress in Neuro-Psychopharmacology and Biological Psychiatry , vol.27 , Issue.1 , pp. 85-102
    • Vaswani, M.1    Linda, F.K.2    Ramesh, S.3
  • 53
    • 24644470065 scopus 로고    scopus 로고
    • --dependent neurotransmitter transporters
    • DOI 10.1038/nature03978
    • Yamashita, A., Singh, S.K., Kawate, T., Jin, Y., Gouaux, E., 2005. Crystal structure of a bacterial homologue of Na+/Cl-dependent neurotransmitter transporters. Nature 437, 215-223. (Pubitemid 41294479)
    • (2005) Nature , vol.437 , Issue.7056 , pp. 215-223
    • Yamashita, A.1    Singh, S.K.2    Kawate, T.3    Jin, Y.4    Gouaux, E.5
  • 54
    • 34548684744 scopus 로고    scopus 로고
    • LeuT-desipramine structure reveals how antidepressants block neurotransmitter reuptake
    • DOI 10.1126/science.1147614
    • Zhou, Z., Zhen, J., Karpowich, N.K., Goetz, R.M., Law, C.J., Reith, M.E., Wang, D.N., 2007. LeuTedesipramine structure reveals how antidepressants block neurotransmitter reuptake. Science 317, 1390-1393. (Pubitemid 47417479)
    • (2007) Science , vol.317 , Issue.5843 , pp. 1390-1393
    • Zhou, Z.1    Zhen, J.2    Karpowich, N.K.3    Goetz, R.M.4    Law, C.J.5    Reith, M.E.A.6    Wang, D.-N.7
  • 55
    • 67349282342 scopus 로고    scopus 로고
    • Antidepressant specificity of serotonin transporter suggested by three LeuTeSSRI structures
    • Zhou, Z., Zhen, J., Karpowich, N.K., Law, C.J., Reith, M.E., Wang, D.N., 2009. Antidepressant specificity of serotonin transporter suggested by three LeuTeSSRI structures. Nat. Struct. Mol. Biol. 16, 652-657.
    • (2009) Nat. Struct. Mol. Biol. , vol.16 , pp. 652-657
    • Zhou, Z.1    Zhen, J.2    Karpowich, N.K.3    Law, C.J.4    Reith, M.E.5    Wang, D.N.6
  • 56
    • 20144378948 scopus 로고    scopus 로고
    • Transporter-associated currents in the γ-aminobutyric acid transporter GAT-1 are conditionally impaired by mutations of a conserved glycine residue
    • DOI 10.1074/jbc.M412937200
    • Zhou, Y., Kanner, B.I., 2005. Transporter-associated currents in the gammaaminobutyric acid transporter GAT-1 are conditionally impaired by mutations of a conserved glycine residue. J. Biol. Chem. 280, 20316-20324. (Pubitemid 40776729)
    • (2005) Journal of Biological Chemistry , vol.280 , Issue.21 , pp. 20316-20324
    • Zhou, Y.1    Kanner, B.I.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.