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Volumn 17, Issue 8, 2012, Pages 9529-9539

Hologram QSAR models of 4-[(Diethylamino)methyl]-phenol inhibitors of acetyl/butyrylcholinesterase enzymes as potential anti-alzheimer agents

Author keywords

Acetylcholinesterase; Alzheimer's disease (AD); Butyrylcholinesterase; HQSAR

Indexed keywords

ACETYLCHOLINESTERASE; CHOLINESTERASE; CHOLINESTERASE INHIBITOR; PHENOL;

EID: 84865469891     PISSN: None     EISSN: 14203049     Source Type: Journal    
DOI: 10.3390/molecules17089529     Document Type: Article
Times cited : (17)

References (27)
  • 2
    • 77949335521 scopus 로고    scopus 로고
    • The worldwide societal costs of dementia: Estimates for 2009
    • Wimo, A.; Winblad, B.; Jönsson, L. The worldwide societal costs of dementia: Estimates for 2009. Alzheimers Dement. 2010, 6, 98-103.
    • (2010) Alzheimers Dement , vol.6 , pp. 98-103
    • Wimo, A.1    Winblad, B.2    Jönsson, L.3
  • 4
    • 67649878812 scopus 로고    scopus 로고
    • The rat as an animal model of Alzheimer's disease
    • Benedikz, E.; Kloskowska, E.; Winblad, B. The rat as an animal model of Alzheimer's disease. J. Cell. Mol. Med. 2009, 13, 1034-1042.
    • (2009) J. Cell. Mol. Med. , vol.13 , pp. 1034-1042
    • Benedikz, E.1    Kloskowska, E.2    Winblad, B.3
  • 5
    • 33646234244 scopus 로고    scopus 로고
    • Approaches to palliative therapies for alzheimers disease
    • Robichaud, A.J. Approaches to Palliative Therapies for Alzheimers Disease. Curr. Top. Med. Chem. 2006, 6, 553-568.
    • (2006) Curr. Top. Med. Chem. , vol.6 , pp. 553-568
    • Robichaud, A.J.1
  • 6
    • 0029147991 scopus 로고
    • The medicinal chemistry of Alzheimer's and Alzheimer-like diseases with emphasis on the cholinergic hypothesis
    • Gualtieri, F.; Dei, S.; Manetti, D.; Novella Romanelli, M.; Scapecchi, S.; Teodori, E. The medicinal chemistry of Alzheimer's and Alzheimer-like diseases with emphasis on the cholinergic hypothesis. Farmaco Prat. 1995, 50, 489-503.
    • (1995) Farmaco Prat , vol.50 , pp. 489-503
    • Gualtieri, F.1    Dei, S.2    Manetti, D.3    Novella Romanelli, M.4    Scapecchi, S.5    Teodori, E.6
  • 7
    • 33750445930 scopus 로고    scopus 로고
    • The significance of the cholinergic system in the brain during aging and in Alzheimer's disease
    • Schliebs, R.; Arendt, T. The significance of the cholinergic system in the brain during aging and in Alzheimer's disease. J. Neural. Transm. 2006, 113, 1625-1644.
    • (2006) J. Neural. Transm. , vol.113 , pp. 1625-1644
    • Schliebs, R.1    Arendt, T.2
  • 8
    • 0042020173 scopus 로고    scopus 로고
    • Treatment of Alzheimer's disease; Current status and new perspectives
    • Scarpini, E.; Schelterns, P.; Feldman, H. Treatment of Alzheimer's disease; current status and new perspectives. Lancet Neurol. 2003, 2, 539-547.
    • (2003) Lancet Neurol , vol.2 , pp. 539-547
    • Scarpini, E.1    Schelterns, P.2    Feldman, H.3
  • 10
    • 4043074138 scopus 로고    scopus 로고
    • Cholinesterase inhibitors: New roles and therapeutic alternatives
    • Giacobini, E. Cholinesterase inhibitors: New roles and therapeutic alternatives. Pharmacol. Res. 2004, 50, 433-440.
    • (2004) Pharmacol. Res. , vol.50 , pp. 433-440
    • Giacobini, E.1
  • 11
    • 0040790523 scopus 로고    scopus 로고
    • Molecular hologram QSAR
    • Parrill, A.L., Reddy, M.R., Eds.; American Chemical Society: Washington, DC, USA Chapter 14
    • Heritage, T.W.; Lowis, D.R. Molecular Hologram QSAR. In Rational Drug Design: Novel Methodology and Practical Applications; Parrill, A.L., Reddy, M.R., Eds.; American Chemical Society: Washington, DC, USA, 1999; Volume 719, Chapter 14, pp. 212-225.
    • (1999) Rational Drug Design: Novel Methodology and Practical Applications , vol.719 , pp. 212-225
    • Heritage, T.W.1    Lowis, D.R.2
  • 12
    • 77958126601 scopus 로고    scopus 로고
    • Recent advances in fragment-based QSAR and multi-dimensional QSAR methods
    • Myint, K.Z.; Xie, X.-Q. Recent Advances in Fragment-Based QSAR and Multi-Dimensional QSAR Methods. Int. J. Mol. Sci. 2010, 11, 3846-3866.
    • (2010) Int. J. Mol. Sci. , vol.11 , pp. 3846-3866
    • Myint, K.Z.1    Xie, X.-Q.2
  • 13
    • 67049158574 scopus 로고    scopus 로고
    • Current mathematical methods used in QSAR/QSPR studies
    • Liu, P.; Long, W. Current Mathematical Methods Used in QSAR/QSPR Studies. Int. J. Mol. Sci. 2009, 10, 1978-1998.
    • (2009) Int. J. Mol. Sci. , vol.10 , pp. 1978-1998
    • Liu, P.1    Long, W.2
  • 14
    • 28844436051 scopus 로고    scopus 로고
    • Two- and three-dimensional quantitative structure-activity relationships for a series of purine nucleoside phosphorylase inhibitors
    • Castilho, M.S.; Postigo, M.P.; de Paula, C.B.V.; Montanari, C.A.; Oliva, G.; Andricopulo, A.D. Two- and three-dimensional quantitative structure-activity relationships for a series of purine nucleoside phosphorylase inhibitors. Bioorg. Med. Chem. 2006, 14, 516-527.
    • (2006) Bioorg. Med. Chem. , vol.14 , pp. 516-527
    • Castilho, M.S.1    Postigo, M.P.2    De Paula, C.B.V.3    Montanari, C.A.4    Oliva, G.5    Andricopulo, A.D.6
  • 15
    • 84865506905 scopus 로고    scopus 로고
    • HQSARTM; Tripos: St. Louis, MO, USA, 2010
    • HQSARTM; Tripos: St. Louis, MO, USA, 2010.
  • 16
    • 77953285226 scopus 로고    scopus 로고
    • Synthesis of 4-[(diethylamino)methyl] phenol derivatives as novel cholinesterase inhibitors with selectivity towards butyrylcholinesterase
    • Yu, L.; Cao, R.; Yi, W.; Yan, Q.; Chen, Z.; Ma, L.; Peng, W.; Song, H. Synthesis of 4-[(diethylamino)methyl]-phenol derivatives as novel cholinesterase inhibitors with selectivity towards butyrylcholinesterase. Bioorg. Med. Chem. Lett. 2010, 20, 3254-3258.
    • (2010) Bioorg. Med. Chem. Lett. , vol.20 , pp. 3254-3258
    • Yu, L.1    Cao, R.2    Yi, W.3    Yan, Q.4    Chen, Z.5    Ma, L.6    Peng, W.7    Song, H.8
  • 18
    • 38749090154 scopus 로고    scopus 로고
    • 2D QSAR and similarity studies on cruzain inhibitors aimed at improving selectivity over cathepsin L
    • Freitas, R.F.; Oprea, T.I.; Montanari, C.A. 2D QSAR and similarity studies on cruzain inhibitors aimed at improving selectivity over cathepsin L. Bioorg. Med. Chem. Lett. 2008, 16, 838-853.
    • (2008) Bioorg. Med. Chem. Lett. , vol.16 , pp. 838-853
    • Freitas, R.F.1    Oprea, T.I.2    Montanari, C.A.3
  • 19
    • 0023751431 scopus 로고    scopus 로고
    • Comparative molecular field analysis (CoMFA). 1. Effect of shape on binding of steroids to carrier proteins
    • Cramer, R.D.; Patterson, D.E.; Bunce, J.D. Comparative molecular field analysis (CoMFA). 1. Effect of shape on binding of steroids to carrier proteins. J. Am. Chem. Soc. 1998, 110, 5959-5967.
    • (1998) J. Am. Chem. Soc. , vol.110 , pp. 5959-5967
    • Cramer, R.D.1    Patterson, D.E.2    Bunce, J.D.3
  • 20
    • 78650226214 scopus 로고    scopus 로고
    • Rationalization of physicochemical properties of alkanoic acid derivatives towards histone deacetylase inhibition. internet electron
    • Jaiswal, D.; Karthikeyan, C.; Trivedi, P. Rationalization of Physicochemical Properties of Alkanoic Acid Derivatives towards Histone Deacetylase Inhibition. Internet Electron. J. Mol. Des. 2006, 5, 13-26.
    • (2006) J. Mol. Des. , vol.5 , pp. 13-26
    • Jaiswal, D.1    Karthikeyan, C.2    Trivedi, P.3
  • 21
    • 69949089936 scopus 로고    scopus 로고
    • Pyrano [3,2-c]quinoline-6-chlorotacrine hybrids as a novel family of acetylcholinesterase- and β-amyloid-directed anti-alzheimer compounds
    • Camps, P.; Formosa, X.; Galdeano, C.; Muñoz-Torrero, D.; Ramírez, L.; Gómez, E.; Isambert, N.; Lavilla, R.; Badia, A.; Clos, M.V.; et al. Pyrano[3,2-c]quinoline-6-Chlorotacrine Hybrids as a Novel Family of Acetylcholinesterase- and β-Amyloid-Directed Anti-Alzheimer Compounds. J. Med. Chem. 2009, 52, 5365-5379.
    • (2009) J. Med. Chem. , vol.52 , pp. 5365-5379
    • Camps, P.1    Formosa, X.2    Galdeano, C.3    Muñoz-Torrero, D.4    Ramírez, L.5    Gómez, E.6    Isambert, N.7    Lavilla, R.8    Badia, A.9    Clos, M.V.10
  • 22
    • 64249150263 scopus 로고    scopus 로고
    • Synthesis, biological evaluation and molecular modeling of oxoisoaporphine and oxoaporphine derivatives as new dual inhibitors of acetylcholinesterase/butyrylcholinesterase
    • Tang, H.; Wei, Y.-B.; Zhang, C.; Ning, F.-X.; Qiao, W.; Huang, S.-L.; Ma, L.; Huang, Z.-S.; Gu, L.-Q. Synthesis, biological evaluation and molecular modeling of oxoisoaporphine and oxoaporphine derivatives as new dual inhibitors of acetylcholinesterase/butyrylcholinesterase. Eur. J. Med. Chem. 2009, 44, 2523-2532.
    • (2009) Eur. J. Med. Chem. , vol.44 , pp. 2523-2532
    • Tang, H.1    Wei, Y.-B.2    Zhang, C.3    Ning, F.-X.4    Qiao, W.5    Huang, S.-L.6    Ma, L.7    Huang, Z.-S.8    Gu, L.-Q.9
  • 24
    • 79851514827 scopus 로고    scopus 로고
    • Discovery of dual binding site acetylcholinesterase inhibitors identified by pharmacophore modeling and sequential virtual screening techniques
    • Gupta, S.; Fallarero, A.; Järvinen, P.; Karlsson, D.; Johnson, M.S.; Vuorela, P.M.; Mohan, C.G. Discovery of dual binding site acetylcholinesterase inhibitors identified by pharmacophore modeling and sequential virtual screening techniques. Bioorg. Med. Chem. Lett. 2011, 21, 1105-1112.
    • (2011) Bioorg. Med. Chem. Lett. , vol.21 , pp. 1105-1112
    • Gupta, S.1    Fallarero, A.2    Järvinen, P.3    Karlsson, D.4    Johnson, M.S.5    Vuorela, P.M.6    Mohan, C.G.7
  • 25
    • 84856936023 scopus 로고    scopus 로고
    • Wavefunction Inc.: Irvine CA USA
    • SPARTAN'10; Wavefunction, Inc.: Irvine, CA, USA, 2011.
    • (2011) SPARTAN'10
  • 26
    • 84865462094 scopus 로고    scopus 로고
    • Tripos International: St. Louis MO USA
    • SYBYL 8.0; Tripos International: St. Louis, MO, USA, 2010.
    • (2010) SYBYL 8.0
  • 27
    • 2942705823 scopus 로고    scopus 로고
    • Hologram quantitative structure activity relationship studies on 5-HT6 antagonists
    • Doddareddy, M.R.; Lee, Y.J.; Cho, Y.S.; Choi, K.I.; Koh, H.Y.; Pae, A.N. Hologram quantitative structure activity relationship studies on 5-HT6 antagonists. Bioorg. Med. Chem. 2004, 12, 3815-3824.
    • (2004) Bioorg. Med. Chem. , vol.12 , pp. 3815-3824
    • Doddareddy, M.R.1    Lee, Y.J.2    Cho, Y.S.3    Choi, K.I.4    Koh, H.Y.5    Pae, A.N.6


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.