메뉴 건너뛰기




Volumn 6, Issue 6, 2011, Pages 619-631

Progress in structure-based drug design against influenza A virus

Author keywords

allosteric mechanism; drug resistance; H1N1; H5N1; influenza A virus; neuraminidase; oseltamivir; rational drug design

Indexed keywords

1, 4 [4 [(3 (2 AMINO 4 HYDROXY 6 METHYL 5 PYRIMIDINYL) PROPYL]AMINO]PHENYL] 1 CHLORO 3 BUTEN 2 ONE; AMANTADINE; ANTIVIRUS AGENT; DANA; INFLUENZA VIRUS HEMAGGLUTININ; KANAMYCIN C; NCI 0605737; NCI 0605741; NCI 0606258; NCI 0607158; NCI 0608643; NCI 0608650; NCI 0624650; NSC 89853; OSELTAMIVIR; OSELTAMIVIR CH2 DANA; OSELTAMIVIR CH2 OSELTAMIVIR; OSELTAMIVIR CH2 ZANAMIVIR; OSELTAMIVIR O ANAMIVIR; PERAMIVIR; PROTEIN M2; PROTOVERINE; PYRIMIDINE DERIVATIVE; RIMANTADINE; UNCLASSIFIED DRUG; VIRUS SIALIDASE; ZANAMIVIR;

EID: 79957552693     PISSN: 17460441     EISSN: 1746045X     Source Type: Journal    
DOI: 10.1517/17460441.2011.571671     Document Type: Review
Times cited : (12)

References (80)
  • 2
    • 77955386821 scopus 로고    scopus 로고
    • Seroprevalence following the second wave of pandemic 2009 H1N1 influenza in Pittsburgh
    • Zimmer SM, Crevar CJ, Carter DM, et al. Seroprevalence following the second wave of pandemic 2009 H1N1 influenza in Pittsburgh. PLoS One 2010;5:e11601
    • (2010) PLoS One , vol.5
    • Zimmer, S.M.1    Crevar, C.J.2    Carter, D.M.3
  • 3
    • 79957537227 scopus 로고    scopus 로고
    • Swine flu danger appears to be ebbing
    • 19 March Available from: Retrieved 20 March 2010
    • Maugh TH II. Swine flu danger appears to be ebbing. Los Angeles Times (19 March 2010). Available from: http://articles.latimes.com/2010/mar/19/science/ la-sci-swine-flu20-2010mar20 [Retrieved 20 March 2010]
    • (2010) Los Angeles Times
    • Maugh II, T.H.1
  • 4
    • 56449084239 scopus 로고    scopus 로고
    • Design of multi-binding-site inhibitors, ligand efficiency, and consensus screening of avian influenza H5N1 wild-type neuraminidase and of the oseltamivir-resistant H274Y variant
    • Garcia-Sosa AT, Sild S, Maran U. Design of multi-binding-site inhibitors, ligand efficiency, and consensus screening of avian influenza H5N1 wild-type neuraminidase and of the oseltamivir-resistant H274Y variant. J Chem Inf Model 2008;48:2074-80
    • (2008) J Chem Inf Model , vol.48 , pp. 2074-2080
    • Garcia-Sosa, A.T.1    Sild, S.2    Maran, U.3
  • 5
    • 79957551168 scopus 로고    scopus 로고
    • World-Health-Organization (WHO) Available from: Retrieved 10 August 2010
    • World-Health-Organization (WHO) WHO declares end of H1N1 pandemic. Available from: http://www.pediatricsupersite.com/view.aspx?rid=67459 [Retrieved 10 August 2010]
    • WHO Declares End of H1N1 Pandemic
  • 6
    • 33644536465 scopus 로고    scopus 로고
    • Adamantane resistance among influenza A viruses isolated early during the 2005-2006 influenza season in the United States
    • Bright RA, Shay DK, Shu B, et al. Adamantane resistance among influenza A viruses isolated early during the 2005-2006 influenza season in the United States. J Am Med Assoc 2006;295:891-4
    • (2006) J Am Med Assoc , vol.295 , pp. 891-894
    • Bright, R.A.1    Shay, D.K.2    Shu, B.3
  • 10
    • 0034084227 scopus 로고    scopus 로고
    • Discovery and development of GS 4104 (oseltamivir): An orally active influenza neuraminidase inhibitor
    • Lew W, Chen X, Kim CU. Discovery and development of GS 4104 (oseltamivir): an orally active influenza neuraminidase inhibitor. Curr Med Chem 2000;7:663-72 (Pubitemid 30396423)
    • (2000) Current Medicinal Chemistry , vol.7 , Issue.6 , pp. 663-672
    • Lew, W.1    Chen, X.2    Kim, C.U.3
  • 11
    • 0032710055 scopus 로고    scopus 로고
    • Zanamivir: A review of its use in influenza
    • DOI 10.2165/00003495-199958040-00016
    • Dunn CJ, Goa KL. Zanamivir: a review of its use in influenza. Drugs 1999;58:761-84 (Pubitemid 29520519)
    • (1999) Drugs , vol.58 , Issue.4 , pp. 761-784
    • Dunn, C.J.1    Gon, K.L.2
  • 12
    • 38749106195 scopus 로고    scopus 로고
    • Structure and mechanism of the M2 proton channel of influenza A virus
    • DOI 10.1038/nature06531, PII NATURE06531
    • Schnell JR, Chou JJ. Structure and mechanism of the M2 proton channel of influenza A virus. Nature 2008;451:591-5 (Pubitemid 351186272)
    • (2008) Nature , vol.451 , Issue.7178 , pp. 591-595
    • Schnell, J.R.1    Chou, J.J.2
  • 13
    • 66149112971 scopus 로고    scopus 로고
    • Mechanism of drug inhibition and drug resistance of influenza A M2 channel
    • Pielak RM, Jason JR, Schnell R, et al. Mechanism of drug inhibition and drug resistance of influenza A M2 channel. Proc Natl Acad Sci USA 2009;106:7379-84
    • (2009) Proc Natl Acad Sci USA , vol.106 , pp. 7379-7384
    • Pielak, R.M.1    Jason, J.R.2    Schnell, R.3
  • 14
    • 77955576540 scopus 로고    scopus 로고
    • Magic Angle Spinning NMR Investigation of Influenza A M218?60: Support for an allosteric mechanism of inhibition
    • Andreas LB, Eddy MT, Pielak RM, et al. Magic Angle Spinning NMR Investigation of Influenza A M218?60: support for an allosteric mechanism of inhibition. J Am Chem Soc 2010;132:10958-960
    • (2010) J Am Chem Soc , vol.132 , pp. 10958-10960
    • Andreas, L.B.1    Eddy, M.T.2    Pielak, R.M.3
  • 15
    • 56349166106 scopus 로고    scopus 로고
    • An in-depth analysis of the biological functional studies based on the NMR M2 channel structure of influenza A virus
    • Huang RB, Du QS, Wang CH, et al. An in-depth analysis of the biological functional studies based on the NMR M2 channel structure of influenza A virus. Biochem Biophys Res Commun 2008;377:1243-47
    • (2008) Biochem Biophys Res Commun , vol.377 , pp. 1243-1247
    • Huang, R.B.1    Du, Q.S.2    Wang, C.H.3
  • 16
    • 67349139888 scopus 로고    scopus 로고
    • Energetic analysis of the two controversial drug binding sites of the M2 proton channel in influenza A virus
    • Du QS, Huang RB, Wang CH, et al. Energetic analysis of the two controversial drug binding sites of the M2 proton channel in influenza A virus. J Theor Biol 2009;259:159-64
    • (2009) J Theor Biol , vol.259 , pp. 159-164
    • Du, Q.S.1    Huang, R.B.2    Wang, C.H.3
  • 17
    • 67650073942 scopus 로고    scopus 로고
    • Investigation into Adamantane- Based M2 Inhibitors with FB-QSAR
    • Wei H, Wang CH, Du QS, et al. Investigation into Adamantane- Based M2 Inhibitors with FB-QSAR. Med Chem 2009;5:305-17
    • (2009) Med Chem , vol.5 , pp. 305-317
    • Wei, H.1    Wang, C.H.2    Du, Q.S.3
  • 18
    • 0019119577 scopus 로고
    • A revision of the system of nomenclature for influenza viruses
    • World-Health-Organization (WHO)
    • World-Health-Organization (WHO). A revision of the system of nomenclature for influenza viruses. WHO Memorandum Bull 1980;58:585-91
    • (1980) WHO Memorandum Bull , vol.58 , pp. 585-591
  • 19
    • 0001178031 scopus 로고    scopus 로고
    • Orthomyxoviruses
    • Knipe DM, Howley PM, editors, 4th edition. Lippincott, Williams & Wilkins, Philadelphia, USA;
    • Wright PF, Webster RG. Orthomyxoviruses. In: Knipe DM, Howley PM, editors, In Fields Virology. 4th edition. Lippincott, Williams & Wilkins, Philadelphia, USA; 2001. p. 1533-79
    • (2001) Fields Virology , pp. 1533-1579
    • Wright, P.F.1    Webster, R.G.2
  • 20
    • 0001178029 scopus 로고    scopus 로고
    • Orthomyxoviridae: The viruses and their replication
    • Knipe DM, Howley PM, editors, 4th edition. Lippincott, Williams & Wilkins, Philadelphia, USA;
    • Lamb RA, Krug RM. Orthomyxoviridae: the viruses and their replication. In: Knipe DM, Howley PM, editors, In Fields Virology. 4th edition. Lippincott, Williams & Wilkins, Philadelphia, USA; 2001. p. 1487-1532
    • (2001) Fields Virology , pp. 1487-1532
    • Lamb, R.A.1    Krug, R.M.2
  • 22
    • 36249003887 scopus 로고    scopus 로고
    • Origin of highly pathogenic H5N1 avian influenza virus in China and genetic characterization of donor and recipient viruses
    • DOI 10.1099/vir.0.83129-0
    • Mukhtar MM, Rasool ST, Song D, et al. Origin of highly pathogenic H5N1 avian influenza virus in China and genetic characterization of donor and recipient viruses. J Gen Virol 2007;88:3094-99 (Pubitemid 350131250)
    • (2007) Journal of General Virology , vol.88 , Issue.11 , pp. 3094-3099
    • Mukhtar, M.M.1    Rasool, S.T.2    Song, D.3    Zhu, C.4    Hao, Q.5    Zhu, Y.6    Wu, J.7
  • 23
    • 26444506691 scopus 로고    scopus 로고
    • Characterization of the 1918 influenza virus polymerase genes
    • Taubenberger JK, Reid AH, Lourens RM, et al. Characterization of the 1918 influenza virus polymerase genes. Nature 2005;437:889-93
    • (2005) Nature , vol.437 , pp. 889-893
    • Taubenberger, J.K.1    Reid, A.H.2    Lourens, R.M.3
  • 24
    • 29144433925 scopus 로고    scopus 로고
    • Oseltamivir resistance - Disabling our influenza defenses
    • DOI 10.1056/NEJMp058291
    • Moscona A. Oseltamivir resistance - disabling our influenza defenses. N Engl J Med 2005;353:2633-6 (Pubitemid 41817709)
    • (2005) New England Journal of Medicine , vol.353 , Issue.25 , pp. 2633-2636
    • Moscona, A.1
  • 25
    • 0032710055 scopus 로고    scopus 로고
    • Zanamivir: A review of its use in influenza
    • DOI 10.2165/00003495-199958040-00016
    • Dunn CJ, Goa KL, Zanamivir: a review of its use in influenza. Drugs 1999;58:761-84 (Pubitemid 29520519)
    • (1999) Drugs , vol.58 , Issue.4 , pp. 761-784
    • Dunn, C.J.1    Gon, K.L.2
  • 27
    • 62349105166 scopus 로고    scopus 로고
    • Oseltamivir resistant influenza viruses A (H1N1), Norway, 2007-08
    • Hauge SH, Dudman S, Borgen K, et al. Oseltamivir resistant influenza viruses A (H1N1), Norway, 2007-08. Emerg Infect Dis 2009;15:155-62
    • (2009) Emerg Infect Dis , vol.15 , pp. 155-162
    • Hauge, S.H.1    Dudman, S.2    Borgen, K.3
  • 28
    • 61849118968 scopus 로고    scopus 로고
    • Global Transmission of oseltamivir-resistant influenza
    • Moscona A. Global Transmission of oseltamivir-resistant influenza. N Engl J Med 2009;360:953-6
    • (2009) N Engl J Med , vol.360 , pp. 953-956
    • Moscona, A.1
  • 30
    • 14744293108 scopus 로고    scopus 로고
    • Oseltamivir (Tamiflu) and its potential for use in the event of an influenza pandemic
    • Ward P, Small I, Smith J, et al. Oseltamivir (Tamiflu) and its potential for use in the event of an influenza pandemic. J Antimicrob Chemother 2005;55:15-121
    • (2005) J Antimicrob Chemother , vol.55 , pp. 15-121
    • Ward, P.1    Small, I.2    Smith, J.3
  • 31
    • 27644439501 scopus 로고    scopus 로고
    • Susceptibilities of antiviral-resistant influenza viruses to novel neuraminidase inhibitors
    • DOI 10.1128/AAC.49.11.4515-4520.2005
    • Mishin VP, Hayden FG, Gubareva LV. Susceptibilities of antiviral resistant influenza viruses to novel neuraminidase inhibitors. Antimicrob Agents Chemother 2005;49:4515-20 (Pubitemid 41552580)
    • (2005) Antimicrobial Agents and Chemotherapy , vol.49 , Issue.11 , pp. 4515-4520
    • Mishin, V.P.1    Hayden, F.G.2    Gubareva, L.V.3
  • 32
    • 33644879977 scopus 로고    scopus 로고
    • Recovery of drug-resistant influenza virus from immunocompromised patients: A case series
    • Ison MG, Gubareva LV, Atmar RL, et al. Recovery of drug-resistant influenza virus from immunocompromised patients: a case series. J Infect Dis 2006;193:760-4
    • (2006) J Infect Dis , vol.193 , pp. 760-764
    • Ison, M.G.1    Gubareva, L.V.2    Atmar, R.L.3
  • 33
    • 0030121940 scopus 로고    scopus 로고
    • Modeling lipophilicity from the distribution of electrostatic potential on a molecular surface
    • Du QS, Arteca GA. Modeling lipophilicity from the distribution of electrostatic potential on a molecular surface. J Comput-Aided Mol Des 1996;10:133-9
    • (1996) J Comput-Aided Mol des , vol.10 , pp. 133-139
    • Du, Q.S.1    Arteca, G.A.2
  • 34
    • 84962422624 scopus 로고    scopus 로고
    • Derivation of fused-sphere molecular surfaces from properties of the electrostatic potential distribution
    • Du QS, Arteca GA. Derivation of fused-sphere molecular surfaces from the electrostatic potential distribution. J Comput Chem 1996;17:1258-68 (Pubitemid 126562031)
    • (1996) Journal of Computational Chemistry , vol.17 , Issue.10 , pp. 1258-1268
    • Du, Q.1    Arteca, G.A.2
  • 35
    • 0031228749 scopus 로고    scopus 로고
    • Heuristic lipophilicity potential for computer-aided rational drug design
    • Du QS, Arteca GA, Mezey PG. Heuristic molecular lipophilicity potential for computer-aided rational drug design. J Comput-Aided Mol Des 1997;11:503-15 (Pubitemid 127505901)
    • (1997) Journal of Computer-Aided Molecular Design , vol.11 , Issue.5 , pp. 503-515
    • Du, Q.1    Arteca, G.A.2    Mezey, P.G.3
  • 36
    • 0032151474 scopus 로고    scopus 로고
    • Heuristic molecular lipophilicity potential for computer-aided rational drug design: Optimizations of screening functions and parameters
    • Du QS, Mezey PG. Heuristic molecular lipophilicity potential for computer-aided rational drug design: optimizations of screening functions and parameters. J Comput-Aided Mol Des 1998;12:451-71
    • (1998) J Comput-Aided Mol des , vol.12 , pp. 451-471
    • Du, Q.S.1    Mezey, P.G.2
  • 37
    • 18344382749 scopus 로고    scopus 로고
    • Theoretical derivation of heuristic molecular lipophilicity potential: A quantum chemical description for molecular solvation
    • DOI 10.1021/ci0497071
    • Du QS, Liu PJ, Mezey P. Theoretical derivation of heuristic molecular lipophilicity potential: a quantum chemical description for molecular solvation. J Chem Inf Model 2005;45:347-53 (Pubitemid 40635341)
    • (2005) Journal of Chemical Information and Modeling , vol.45 , Issue.2 , pp. 347-353
    • Du, Q.1    Liu, P.-J.2    Mezey, P.G.3
  • 38
    • 33645705344 scopus 로고    scopus 로고
    • Heuristic molecular lipophilicity potential (HMLP): Lipophilicity and hydrophilicity of amino acid side chains
    • Du QS, Li DP, He WZ, Chou KC. Heuristic molecular lipophilicity potential (HMLP): lipophilicity and hydrophilicity of amino acid side chains. J Comput Chem 2006;27:685-92
    • (2006) J Comput Chem , vol.27 , pp. 685-692
    • Du, Q.S.1    Li, D.P.2    He, W.Z.3    Chou, K.C.4
  • 39
    • 77952835065 scopus 로고    scopus 로고
    • Advances in visual representations of chemical spaces
    • Du QS, Huang RB, Chou KC. Advances in visual representations of chemical spaces. Expert Opin Drug Discov 2010;5:513-27
    • (2010) Expert Opin Drug Discov , vol.5 , pp. 513-527
    • Du, Q.S.1    Huang, R.B.2    Chou, K.C.3
  • 40
    • 84945736084 scopus 로고
    • 2-Deoxy-2,3-dehydrosialic acids. II. Competitive inhibition of Vibrio cholerae neuraminidase by 2-deoxy-2,3-dehydro-N-acylneuraminic acids
    • Meindl P, Tuppy H. 2-Deoxy-2,3-dehydrosialic acids. II. Competitive inhibition of Vibrio cholerae neuraminidase by 2-deoxy-2,3-dehydro-N- acylneuraminic acids. Hoppe Seylers Z Physiol Chem 1969;350:1088-92
    • (1969) Hoppe Seylers Z Physiol Chem , vol.350 , pp. 1088-1092
    • Meindl, P.1    Tuppy, H.2
  • 41
    • 0015959249 scopus 로고
    • Inhibition of neuraminidase activity by derivatives of 2-deoxy-2,3-dehydro-Nacetylneuraminic acid
    • Meindl P, Bodo G, Palese P, et al. Inhibition of neuraminidase activity by derivatives of 2-deoxy-2,3-dehydro-Nacetylneuraminic acid. Virology 1974;58:457-63
    • (1974) Virology , vol.58 , pp. 457-463
    • Meindl, P.1    Bodo, G.2    Palese, P.3
  • 43
    • 67650069265 scopus 로고    scopus 로고
    • Insights from investigating the interaction of oseltamivir (Tamiflu) with neuraminidase of the 2009 H1N1 swine flu virus
    • Wang SQ, Du QS, Huang RB, et al. Insights from investigating the interaction of oseltamivir (Tamiflu) with neuraminidase of the 2009 H1N1 swine flu virus. Biochem Biophys Res Commun 2009;386:432-6
    • (2009) Biochem Biophys Res Commun , vol.386 , pp. 432-436
    • Wang, S.Q.1    Du, Q.S.2    Huang, R.B.3
  • 44
    • 33846617350 scopus 로고    scopus 로고
    • Study of drug resistance of chicken influenza A virus (H5N1) from homology-modeled 3D structures of neuraminidases
    • Wang SQ, Du QS, Chou KC. Study of drug resistance of chicken influenza A virus (H5N1) from homology-modeled 3D structures of neuraminidases. Biochem Biophys Res Commun 2007;354:634-40
    • (2007) Biochem Biophys Res Commun , vol.354 , pp. 634-640
    • Wang, S.Q.1    Du, Q.S.2    Chou, K.C.3
  • 45
    • 73149099925 scopus 로고    scopus 로고
    • Computational 3D structures of drug targeting proteins in the 2009-H1N1 influenza A virus
    • Du QS, Wang Q, Huanga RB, et al. Computational 3D structures of drug targeting proteins in the 2009-H1N1 influenza A virus. Chem Phys Lett 2010;485:191-5
    • (2010) Chem Phys Lett , vol.485 , pp. 191-195
    • Du, Q.S.1    Wang, Q.2    Huanga, R.B.3
  • 46
    • 55249083577 scopus 로고    scopus 로고
    • Structural characterization of the 1918 influenza virus H1N1 neuraminidase
    • Xu X, Zhu X, Dwek RA, et al. Structural characterization of the 1918 influenza virus H1N1 neuraminidase. J Virol 2008;82:10493-501
    • (2008) J Virol , vol.82 , pp. 10493-10501
    • Xu, X.1    Zhu, X.2    Dwek, R.A.3
  • 47
    • 77951976539 scopus 로고    scopus 로고
    • Structures of influenza A proteins and insights into antiviral drug targets
    • Das K, Aramini JM, Ma LC, et al. Structures of influenza A proteins and insights into antiviral drug targets. Nat Struct Mol Biol 2010;17:530-8
    • (2010) Nat Struct Mol Biol , vol.17 , pp. 530-538
    • Das, K.1    Aramini, J.M.2    Ma, L.C.3
  • 48
    • 34548261773 scopus 로고    scopus 로고
    • Analogue inhibitors by modifying oseltamivir based on the crystal neuraminidase structure for treating drug-resistant H5N1 virus
    • Du QS, Wang SQ, Chou KC. Analogue inhibitors by modifying oseltamivir based on the crystal neuraminidase structure for treating drug-resistant H5N1 virus. Biochem Biophys Res Commun 2007;362:525-31
    • (2007) Biochem Biophys Res Commun , vol.362 , pp. 525-531
    • Du, Q.S.1    Wang, S.Q.2    Chou, K.C.3
  • 49
    • 33846617350 scopus 로고    scopus 로고
    • Study of drug resistance of chicken influenza A virus (H5N1) from homology-modeled 3D structures of neuraminidases
    • Wang SQ, Du QS, Chou KC. Study of drug resistance of chicken influenza A virus (H5N1) from homology-modeled 3D structures of neuraminidases. Biochem Biophys Res Commun 2007;354:634-40
    • (2007) Biochem Biophys Res Commun , vol.354 , pp. 634-640
    • Wang, S.Q.1    Du, Q.S.2    Chou, K.C.3
  • 50
    • 0033897803 scopus 로고    scopus 로고
    • Resistance of influenza viruses to neuraminidase inhibitors - A review
    • DOI 10.1016/S0166-3542(00)00103-0, PII S0166354200001030
    • McKimm-Breschkin JL. Resistance of influenza viruses to neuraminidase inhibitors - a review. Antiviral Res 2000;47:1-17 (Pubitemid 30621392)
    • (2000) Antiviral Research , vol.47 , Issue.1 , pp. 1-17
    • McKimm-Breschkin, J.L.1
  • 51
    • 0028943992 scopus 로고
    • Invivo emergence of HIV-1 variants resistant to multiple protease inhibitors
    • Condra JH, Schleif WA, Blahy OM, et al. Invivo emergence of HIV-1 variants resistant to multiple protease inhibitors. Nature 1995;374:569-71
    • (1995) Nature , vol.374 , pp. 569-571
    • Condra, J.H.1    Schleif, W.A.2    Blahy, O.M.3
  • 53
    • 77953267929 scopus 로고    scopus 로고
    • In silico identification of the potential drug resistance sites over 2009 influenza A (H1N1) virus neuraminidase
    • Liu HX, Yao XJ, Wang CQ, et al. In silico identification of the potential drug resistance sites over 2009 influenza A (H1N1) virus neuraminidase. Mol Pharm 2010;7:894-904
    • (2010) Mol Pharm , vol.7 , pp. 894-904
    • Liu, H.X.1    Yao, X.J.2    Wang, C.Q.3
  • 55
    • 58249133943 scopus 로고    scopus 로고
    • De novo design of novel selective COX-2 inhibitors: From virtual screening to pharmacophore analysis
    • Chen CY. De novo design of novel selective COX-2 inhibitors: from virtual screening to pharmacophore analysis. J Taiwan Inst Chem Eng 2009;40:55-69
    • (2009) J Taiwan Inst Chem Eng , vol.40 , pp. 55-69
    • Chen, C.Y.1
  • 59
    • 38549117345 scopus 로고    scopus 로고
    • Computer-Aided Drug Discovery and Development (CADDD): In silico-chemico-biological approach
    • Kapetanovic IM. Computer-Aided Drug Discovery and Development (CADDD): in silico-chemico-biological approach. Chem Biol Interact 2008;17:165-76
    • (2008) Chem Biol Interact , vol.17 , pp. 165-176
    • Kapetanovic, I.M.1
  • 60
    • 0038748179 scopus 로고    scopus 로고
    • Virtual Screening of Virtual Libraries
    • DOI 10.1016/S0079-6468(02)41002-8, PII S0079646802410028
    • Green DV. Virtual screening of virtual libraries. Prog Med Chem 2003;41:61-97 (Pubitemid 137639533)
    • (2003) Progress in Medicinal Chemistry , vol.41 , pp. 61-97
    • Green, D.V.S.1
  • 61
    • 33745123321 scopus 로고    scopus 로고
    • Molecular descriptors and methods for ligand based virtual high throughput screening in drug discovery
    • DOI 10.2174/138161206777585247
    • Pozzan A. Molecular descriptors and methods for ligand based virtual high throughput screening in drug discovery. Curr Pharm Des 2006;12:2099-110 (Pubitemid 43891406)
    • (2006) Current Pharmaceutical Design , vol.12 , Issue.17 , pp. 2099-2110
    • Pozzan, A.M.1
  • 63
    • 65649103683 scopus 로고    scopus 로고
    • A novel small-molecule inhibitor of the avian influenza H5N1 virus determined through computational screening against the neuraminidase
    • An J, Lee DC, Law AH, et al. A novel small-molecule inhibitor of the avian influenza H5N1 virus determined through computational screening against the neuraminidase. J Med Chem 2009;52:2667-72
    • (2009) J Med Chem , vol.52 , pp. 2667-2672
    • An, J.1    Lee, D.C.2    Law, A.H.3
  • 64
    • 58249129231 scopus 로고    scopus 로고
    • Chemoinformatics and pharmacoinformatics approach for exploring the GABA-A agonist from Chinese herb suanzaoren
    • Chen CY. Chemoinformatics and pharmacoinformatics approach for exploring the GABA-A agonist from Chinese herb suanzaoren. J Taiwan Inst Chem Eng 2009;40:36-47
    • (2009) J Taiwan Inst Chem Eng , vol.40 , pp. 36-47
    • Chen, C.Y.1
  • 66
    • 58849145223 scopus 로고    scopus 로고
    • AutoGrow: A novel algorithm for protein inhibitor design
    • Durrant JD, Amaro RE, McCammon JA. AutoGrow: a novel algorithm for protein inhibitor design. Chem Biol Drug Des 2009;73:168-78
    • (2009) Chem Biol Drug des , vol.73 , pp. 168-178
    • Durrant, J.D.1    Amaro, R.E.2    McCammon, J.A.3
  • 68
    • 1942453243 scopus 로고    scopus 로고
    • Ligand efficiency: A useful metric for lead selection
    • DOI 10.1016/S1359-6446(04)03069-7, PII S1359644604030697
    • Hopkins AL, Groom CR, Alex A. Ligand efficiency: a useful metric for lead system. Drug Discov Today 2004;9:430-1 (Pubitemid 38510559)
    • (2004) Drug Discovery Today , vol.9 , Issue.10 , pp. 430-431
    • Hopkins, A.L.1    Groom, C.R.2    Alex, A.3
  • 69
    • 17044403086 scopus 로고    scopus 로고
    • Ligand efficiency indices as guideposts for drug discovery
    • Abad-Zapatero C, Metz JT. Ligand efficiency indices as guideposts for drug discovery. Drug Discov Today 2005;10:464-9
    • (2005) Drug Discov Today , vol.10 , pp. 464-469
    • Abad-Zapatero, C.1    Metz, J.T.2
  • 70
    • 37249004920 scopus 로고    scopus 로고
    • Reaching for high-hanging fruit in drug discovery at protein-protein interfaces
    • DOI 10.1038/nature06526, PII NATURE06526
    • Wells JA, McClendon CL. Reaching for high-hanging fruit in drug discovery at protein-protein interfaces. Nature 2007;450:1001-9 (Pubitemid 350273630)
    • (2007) Nature , vol.450 , Issue.7172 , pp. 1001-1009
    • Wells, J.A.1    McClendon, C.L.2
  • 71
    • 33644876210 scopus 로고    scopus 로고
    • DrugBank: A knowledgebase for drugs, drug actions and drug targets
    • Wishart DS, Knox C, Guo AC, et al. DrugBank: a knowledgebase for drugs, drug actions and drug targets. Nucleic Acids Res 2006;34:668-72
    • (2006) Nucleic Acids Res , vol.34 , pp. 668-672
    • Wishart, D.S.1    Knox, C.2    Guo, A.C.3
  • 73
    • 13844312649 scopus 로고    scopus 로고
    • ZINC?A free database of commercially available compounds for virtual screening
    • Irwin JJ, Shoichet BK. ZINC?A free database of commercially available compounds for virtual screening. J Chem Inf Model 2005;45:177-82
    • (2005) J Chem Inf Model , vol.45 , pp. 177-182
    • Irwin, J.J.1    Shoichet, B.K.2
  • 74
    • 79957541535 scopus 로고    scopus 로고
    • version 4.5; Schrodinger, LLC: New York
    • Glide, version 4.5; Schrodinger, LLC: New York; 2007
    • (2007) Glide
  • 75
    • 70349932423 scopus 로고    scopus 로고
    • AutoDock4 and AutoDockTools4: Automated docking with selective receptor flexibility
    • Morris GM, Huey R, Lindstrom W, et al. AutoDock4 and AutoDockTools4: automated docking with selective receptor flexibility. J Comput Chem 2009;30:2785-91
    • (2009) J Comput Chem , vol.30 , pp. 2785-2791
    • Morris, G.M.1    Huey, R.2    Lindstrom, W.3
  • 76
    • 77957817349 scopus 로고    scopus 로고
    • Three new powerful oseltamivir derivatives for inhibiting the neuraminidase of influenza virus
    • Wang SQ, Cheng XC, Dong WL, et al. Three new powerful oseltamivir derivatives for inhibiting the neuraminidase of influenza virus. Biochem Biophys Res Commun 2010;401:188-91
    • (2010) Biochem Biophys Res Commun , vol.401 , pp. 188-191
    • Wang, S.Q.1    Cheng, X.C.2    Dong, W.L.3
  • 77
    • 77949597169 scopus 로고    scopus 로고
    • Designing inhibitors of M2 proton channel against H1N1 swine influenza virus
    • Du QS, Huang RB, Wang SQ, et al. Designing inhibitors of M2 proton channel against H1N1 swine influenza virus. PLoS One 2010;5:e9388
    • (2010) PLoS One , vol.5
    • Du, Q.S.1    Huang, R.B.2    Wang, S.Q.3
  • 78
    • 77950832743 scopus 로고    scopus 로고
    • Advances in the structure-based design of the influenza A Neuraminidase inhibitors
    • Mitrasinovic PM. Advances in the structure-based design of the influenza A Neuraminidase inhibitors. Curr Drug Targets 2010;11:315-26
    • (2010) Curr Drug Targets , vol.11 , pp. 315-326
    • Mitrasinovic, P.M.1
  • 79
    • 77957767268 scopus 로고    scopus 로고
    • The 2009 pandemic H1N1 neuraminidase N1 lacks the 150-cavity in its active site
    • Li Q, Qi JX, Zhang W, et al. The 2009 pandemic H1N1 neuraminidase N1 lacks the 150-cavity in its active site. Nat Struct Mol Biol 2010;17:1266-8
    • (2010) Nat Struct Mol Biol , vol.17 , pp. 1266-1268
    • Li, Q.1    Qi, J.X.2    Zhang, W.3
  • 80
    • 33646784370 scopus 로고    scopus 로고
    • Combination chemotherapy, a potential strategy for reducing the emergence of drug-resistant influenza A variants
    • DOI 10.1016/j.antiviral.2006.01.012, PII S0166354206000349
    • Ilyushina NA, Bovin NV, Webster RG, et al. Combination chemotherapy, a potential strategy for reducing the emergence of drug-resistant influenza A variants. Antiviral Res 2006;70:121-31 (Pubitemid 43765615)
    • (2006) Antiviral Research , vol.70 , Issue.3 , pp. 121-131
    • Ilyushina, N.A.1    Bovin, N.V.2    Webster, R.G.3    Govorkova, E.A.4


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.