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Volumn 71, Issue 2, 2008, Pages 155-166

Three-dimensional quantitative structure-activity relationship modeling of γ-secretase inhibitors using molecular field analysis

Author keywords

Drug design; Drug discovery; Molecular modeling; Therapeutic target

Indexed keywords

GAMMA SECRETASE INHIBITOR;

EID: 38549155452     PISSN: 17470277     EISSN: None     Source Type: Journal    
DOI: 10.1111/j.1747-0285.2007.00622.x     Document Type: Article
Times cited : (4)

References (27)
  • 1
    • 0032975114 scopus 로고    scopus 로고
    • Death attributable to Alzheimer's disease in the United States
    • Ewbank D.C. (1999) Death attributable to Alzheimer's disease in the United States. Am J Public Health 89 : 90 92.
    • (1999) Am J Public Health , vol.89 , pp. 90-92
    • Ewbank, D.C.1
  • 2
    • 0001181116 scopus 로고    scopus 로고
    • Alzheimer's Disease: Molecular understanding predicts amyloid based therapeutics
    • Selkoe D.J., Schenk D. (2003) Alzheimer's Disease: molecular understanding predicts amyloid based therapeutics. Annu Rev Pharmacol Toxicol 43 : 545 584.
    • (2003) Annu Rev Pharmacol Toxicol , vol.43 , pp. 545-584
    • Selkoe, D.J.1    Schenk, D.2
  • 3
    • 0035927426 scopus 로고    scopus 로고
    • Secretase targets for Alzheimer's disease: Identification and therapeutic potential
    • Wolfe M.S. (2001) Secretase targets for Alzheimer's disease: identification and therapeutic potential. J Med Chem 44 : 2039 2060.
    • (2001) J Med Chem , vol.44 , pp. 2039-2060
    • Wolfe, M.S.1
  • 4
    • 0242361783 scopus 로고    scopus 로고
    • Identity and function of gamma-secretase
    • Taylor K.W., Wolfe M.S. (2003) Identity and function of gamma-secretase. J Neurosci Res 74 : 353 360.
    • (2003) J Neurosci Res , vol.74 , pp. 353-360
    • Taylor, K.W.1    Wolfe, M.S.2
  • 6
    • 0033535504 scopus 로고    scopus 로고
    • A presenilin-1-dependent gamma-secretase-like protease mediates release of Notch intracellular domain
    • De Strooper B., Annaert W., Cupers P., Saftig P., Craessaerts K., Mumms J.S. (1999) A presenilin-1-dependent gamma-secretase-like protease mediates release of Notch intracellular domain. Nature 398 : 518 522.
    • (1999) Nature , vol.398 , pp. 518-522
    • De Strooper, B.1    Annaert, W.2    Cupers, P.3    Saftig, P.4    Craessaerts, K.5    Mumms, J.S.6
  • 7
    • 24944439990 scopus 로고    scopus 로고
    • Gamma-Secretase as a therapeutic target for the treatment of Alzheimer's disease
    • Churcher I., Beher D. (2005) gamma-Secretase as a therapeutic target for the treatment of Alzheimer's disease. Curr Pharm Des 11 : 3363 3382.
    • (2005) Curr Pharm des , vol.11 , pp. 3363-3382
    • Churcher, I.1    Beher, D.2
  • 8
    • 0036653703 scopus 로고    scopus 로고
    • Recent advances in the development of γ-secretase inhibitors
    • Josien H. (2002) Recent advances in the development of γ-secretase inhibitors. Curr Opin Drug Discov Dev 5 : 513 525.
    • (2002) Curr Opin Drug Discov Dev , vol.5 , pp. 513-525
    • Josien, H.1
  • 9
    • 0033606951 scopus 로고    scopus 로고
    • Lead generation using pharmacophore mapping and three-dimensional database searching: Application to muscarinic M(3) receptor antagonists
    • Marriott D.P., Dougall I.G., Meghani P., Liu Y.J., Flower D.R. (1999) Lead generation using pharmacophore mapping and three-dimensional database searching: application to muscarinic M(3) receptor antagonists. J Med Chem 42 : 3210 3216.
    • (1999) J Med Chem , vol.42 , pp. 3210-3216
    • Marriott, D.P.1    Dougall, I.G.2    Meghani, P.3    Liu, Y.J.4    Flower, D.R.5
  • 10
    • 0141882104 scopus 로고
    • Molecular shape analysis: A formalism to quantitatively establish spatial molecular similarity
    • In: Johnson Mark, A., Maggiora Gerald, M., editors. New York: John Wiley & Sons. p. ISBN: 0-471-62175-7; LC 89-49633).
    • Hopfinger A.J., Burke Benjamin J. (1990) Molecular shape analysis: a formalism to quantitatively establish spatial molecular similarity. In : Johnson Mark A., Maggiora Gerald M., editors. Concepts and Applications of Molecular Similarity. New York : John Wiley & Sons p. 173 209 (ISBN: 0-471-62175-7; LC 89-49633).
    • (1990) Concepts and Applications of Molecular Similarity. , pp. 173-209
    • Hopfinger, A.J.1    Burke Benjamin, J.2
  • 11
    • 0023751431 scopus 로고
    • Comparative molecular field analysis (CoMFA): I. Effect of shape on binding of steroids to carrier proteins
    • Cramer R.D. III., Patterson D.E., Bunce J.D. (1988) Comparative molecular field analysis (CoMFA): I. Effect of shape on binding of steroids to carrier proteins. J Am Chem Soc 110 : 5959 5967.
    • (1988) J Am Chem Soc , vol.110 , pp. 5959-5967
    • Cramer Iii., R.D.1    Patterson, D.E.2    Bunce, J.D.3
  • 12
    • 0027944195 scopus 로고
    • Molecular similarity indices in a comparative analysis (CoMSIA) of drug molecules to correlate and predict their biological activity
    • Klebe G., Abraham U., Mietzner T. (1994) Molecular similarity indices in a comparative analysis (CoMSIA) of drug molecules to correlate and predict their biological activity. J Med Chem 37 : 4130 4146.
    • (1994) J Med Chem , vol.37 , pp. 4130-4146
    • Klebe, G.1    Abraham, U.2    Mietzner, T.3
  • 13
    • 0029065636 scopus 로고
    • Receptor surface models. Definition and construction
    • Hahn M. (1995) Receptor surface models. Definition and construction. J Med Chem 38 : 2080 2090.
    • (1995) J Med Chem , vol.38 , pp. 2080-2090
    • Hahn, M.1
  • 14
    • 0029007232 scopus 로고
    • Receptor surface models. Application to quantitative structure-activity relationships
    • Hahn M., Rogers D. (1995) Receptor surface models. Application to quantitative structure-activity relationships. J Med Chem 38 : 2091 2102.
    • (1995) J Med Chem , vol.38 , pp. 2091-2102
    • Hahn, M.1    Rogers, D.2
  • 15
    • 0003741746 scopus 로고    scopus 로고
    • Hopfinger, A.J., Tokarsi, J.S., Charifson, P.S. (. editors. New York: Marcel Dekker.
    • Hopfinger A.J., Tokarsi J.S., Charifson P.S. (editors 1997) Practical Applications of Computer-aided Drug Design. New York : Marcel Dekker.
    • (1997) Practical Applications of Computer-aided Drug Design.
  • 19
    • 0035942322 scopus 로고    scopus 로고
    • Biochemical characterization of the γ-secretase activity that produces β-amyloid peptides
    • Zhang L., Song L., Terracina G., Lui Y., Pramanik B., Parker E. (2001) Biochemical characterization of the γ-secretase activity that produces β-amyloid peptides. Biochemistry 40 : 5049 5055.
    • (2001) Biochemistry , vol.40 , pp. 5049-5055
    • Zhang, L.1    Song, L.2    Terracina, G.3    Lui, Y.4    Pramanik, B.5    Parker, E.6
  • 20
    • 0028237444 scopus 로고
    • Three-dimensional quantitative structure-activity relationship of human immunodeficiency virus (I) protease inhibitors: 2. Predictive power using limited exploration of alternate binding modes
    • Opera T.I., Waller C.L., Marshal G.R. (1994) Three-dimensional quantitative structure-activity relationship of human immunodeficiency virus (I) protease inhibitors: 2. Predictive power using limited exploration of alternate binding modes. J Med Chem 37 : 2206 2215.
    • (1994) J Med Chem , vol.37 , pp. 2206-2215
    • Opera, T.I.1    Waller, C.L.2    Marshal, G.R.3
  • 21
    • 9144240095 scopus 로고
    • DREIDING: A generic force field for molecular simulations
    • Mayo S.L., Olafson B.D., Goddard W.A. (1990) DREIDING: a generic force field for molecular simulations. J Phys Chem 94 : 8897 8909.
    • (1990) J Phys Chem , vol.94 , pp. 8897-8909
    • Mayo, S.L.1    Olafson, B.D.2    Goddard, W.A.3
  • 22
    • 49149147973 scopus 로고
    • Iterative partial equalization of orbital electronegativity - A rapid access to atomic charges
    • Gasteiger J., Marsili M. (1980) Iterative partial equalization of orbital electronegativity - a rapid access to atomic charges. Tetrahedron 36 : 3219 3222.
    • (1980) Tetrahedron , vol.36 , pp. 3219-3222
    • Gasteiger, J.1    Marsili, M.2
  • 23
    • 0842341771 scopus 로고
    • Development and use of quantum mechanical molecular models: 76. AM1: A new general purpose quantum mechanical molecular model
    • Dewar M.J.S., Zoebish E.G., Healy E.F., Stewart J.P. (1985) Development and use of quantum mechanical molecular models: 76. AM1: a new general purpose quantum mechanical molecular model. J Am Chem Soc 107 : 3902 3909.
    • (1985) J Am Chem Soc , vol.107 , pp. 3902-3909
    • Dewar, M.J.S.1    Zoebish, E.G.2    Healy, E.F.3    Stewart, J.P.4
  • 24
    • 0003828004 scopus 로고
    • Wold, S., van da Waterbeemd, H. (. editors. Weinheim: VCH.
    • Wold S., van da Waterbeemd H. (editors 1995) Chemometric Methods in Molecular Design. Weinheim : VCH.
    • (1995) Chemometric Methods in Molecular Design.
  • 25
    • 37349097759 scopus 로고    scopus 로고
    • Y-Randomization and its variants in QSPR/QSAR
    • Rücker C., Rücker G., Meringer M. (2007) y-Randomization and its variants in QSPR/QSAR. J Chem Inf Model 47 : 2345 2357.
    • (2007) J Chem Inf Model , vol.47 , pp. 2345-2357
    • Rücker, C.1    Rücker, G.2    Meringer, M.3
  • 26
    • 0035960060 scopus 로고    scopus 로고
    • Quantitative structure antitumour activity relationships of camptothecin analogues: Cluster analysis and genetic algorithm based study
    • Fan Y., Shi L.M., Kohn K.W., Pommier Y., Weinstein J.N. (2001) Quantitative structure antitumour activity relationships of camptothecin analogues: cluster analysis and genetic algorithm based study. J Med Chem 44 : 3254 3263.
    • (2001) J Med Chem , vol.44 , pp. 3254-3263
    • Fan, Y.1    Shi, L.M.2    Kohn, K.W.3    Pommier, Y.4    Weinstein, J.N.5


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.