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Volumn 3, Issue 1, 2011, Pages 15-27

QSAR analysis of [(biphenyloxy)propyl] isoxazoles: Agents against coxsackievirus B3

Author keywords

[No Author keywords available]

Indexed keywords

2 METHOXY 1 PHENYL 1H IMIDAZO[4,5 C]PYRIDINE; ISOXAZOLE DERIVATIVE; PLECONARIL; PYRIDINE DERIVATIVE; UNCLASSIFIED DRUG;

EID: 78650674481     PISSN: 17568919     EISSN: None     Source Type: Journal    
DOI: 10.4155/fmc.10.278     Document Type: Article
Times cited : (12)

References (48)
  • 1
    • 78649992830 scopus 로고    scopus 로고
    • The human rhinovirus: Human-pathological impact mechanisms of antirhinoviral agents and strategies for their discovery
    • DOI: 10.1002/med.20176 Epub ahead of print).
    • Rollinger JM, Schmidtke M. The human rhinovirus: humanS-pathological impact, mechanisms of antirhinoviral agents and strategies for their discovery. Med. Res. Rev. DOI: 10.1002/med.20176 (2009) (Epub ahead of print).
    • (2009) Med. Res. Rev.
    • Rollinger, J.M.1    Schmidtke, M.2
  • 2
    • 34447577520 scopus 로고    scopus 로고
    • Enteroviruses: Polioviruses coxsackieviruses echoviruses and newer enteroviruses
    • knipe DM, Howley PM Eds Lippincott Williams & Wilkins, PA, USA
    • Pallansch M, Roos R. Enteroviruses: spolioviruses, coxsackieviruses, echoviruses, and newer enteroviruses. In: Fields Virology Knipe DM, Howley PM (Eds). Lippincott Williams & Wilkins, PA, USA 840-893 (2007).
    • (2007) Fields Virology , pp. 840-893
    • Pallansch, M.1    Roos, R.2
  • 3
    • 0038645876 scopus 로고    scopus 로고
    • A formidable challenge: The diagnosis and treatment of viral myocarditis in children
    • Wheeler DS, Kooy NW. A formidable challenge: the diagnosis and treatment of viral myocarditis in children. Crit. Care Clin. 19(3), 365-391 (2003).
    • (2003) Crit. Care Clin. , vol.19 , Issue.3 , pp. 365-391
    • Wheeler, D.S.1    Kooy, N.W.2
  • 4
    • 66349128242 scopus 로고    scopus 로고
    • Viral myocarditis: From the perspective of the virus
    • Yajima T, Knowlton KU. Viral myocarditis: from the perspective of the virus. Circulation 119(19), 2615-2624 (2009).
    • (2009) Circulation , vol.119 , Issue.19 , pp. 2615-2624
    • Yajima, T.1    Knowlton, K.U.2
  • 5
    • 33744990410 scopus 로고    scopus 로고
    • Current status of anti-picornavirus therapies
    • Barnard DL. Current status of anti-picornavirus therapies. Curr. Pharm. Des. 12, 1379-1390 (2006).
    • (2006) Curr. Pharm. Des. , vol.12 , pp. 1379-1390
    • Barnard, D.L.1
  • 7
    • 34547753377 scopus 로고    scopus 로고
    • Picornaviridae: The viruses and their replication
    • Knipe DM, Howley PM Eds Lippincott Williams & Wilkins, PA, USA
    • Racaniello VR. Picornaviridae: the viruses and their replication. In: Fields Virology. Knipe DM, Howley PM (Eds). Lippincott Williams & Wilkins, PA, USA 796-839 (2007).
    • (2007) Fields Virology , pp. 796-839
    • Racaniello, V.R.1
  • 8
    • 0036645722 scopus 로고    scopus 로고
    • Picornavirus-receptor interactions
    • Rossmann MG, He Y, Kuhn RJ. Picornavirus-receptor interactions. Trends Microbiol. 10(7), 324-331 (2002).
    • (2002) Trends Microbiol. , vol.10 , Issue.7 , pp. 324-331
    • Rossmann, M.G.1    He, Y.2    Kuhn, R.J.3
  • 9
    • 0030270640 scopus 로고    scopus 로고
    • Antipicornavirus activity of SCH 47802 and analogs: In vitro and in vivo studies
    • Cox S, Buontempo PJ, Wright-Minogue J et al. Antipicornavirus activity of SCH 47802 and analogs: in vitro and in vivo studies. Antivir. Res. 32(2), 71-79 (1996).
    • (1996) Antivir. Res. , vol.32 , Issue.2 , pp. 71-79
    • Cox, S.1    Buontempo, P.J.2    Wright-Minogue, J.3
  • 10
    • 0033592982 scopus 로고    scopus 로고
    • Analysis of three structurally related antiviral compounds in complex with human rhinovirus 16
    • USA
    • Hadfield AT, Diana GD, Rossmann MG. Analysis of three structurally related antiviral compounds in complex with human rhinovirus 16. Proc. Natl Acad. Sci. USA 96(26), 14730-14735 (1999).
    • (1999) Proc. Natl Acad. Sci. , vol.96 , Issue.26 , pp. 14730-14735
    • Hadfield, A.T.1    Diana, G.D.2    Rossmann, M.G.3
  • 11
    • 0029645145 scopus 로고
    • The structure of coxsackievirus B3 at 3.5 Å resolution
    • Muckelbauer JK, Kremer M, Minor I et al. The structure of coxsackievirus B3 at 3.5 Å resolution. Structure 3(7), 653-667 (1995).
    • (1995) Structure , vol.3 , Issue.7 , pp. 653-667
    • Muckelbauer, J.K.1    Kremer, M.2    Minor, I.3
  • 12
    • 4644342919 scopus 로고    scopus 로고
    • Structural and virological studies of the stages of virus replication that are affected by antirhinovirus compounds
    • Zhang Y, Simpson AA, Ledford RM et al. Structural and virological studies of the stages of virus replication that are affected by antirhinovirus compounds. J. Virol. 78(20), 11061-11069 (2004).
    • (2004) J. Virol. , vol.78 , Issue.20 , pp. 11061-11069
    • Zhang, Y.1    Simpson, A.A.2    Ledford, R.M.3
  • 13
    • 1842509981 scopus 로고    scopus 로고
    • VP1 sequencing of all human rhinovirus serotypes: Insights into genus phylogeny and susceptibility to antiviral capsid-binding compounds
    • Ledford RM, Patel NR, Demenczuk TM et al. VP1 sequencing of all human rhinovirus serotypes: insights into genus phylogeny and susceptibility to antiviral capsid-binding compounds. J. Virol. 78(7), 3663-3674 (2004).
    • (2004) J. Virol. , vol.78 , Issue.7 , pp. 3663-3674
    • Ledford, R.M.1    Patel, N.R.2    Demenczuk, T.M.3
  • 14
    • 27144512687 scopus 로고    scopus 로고
    • Susceptibility of coxsackievirus B3 laboratory strains and clinical isolates to the capsid function inhibitor pleconaril: Antiviral studies with virus chimeras demonstrate the crucial role of amino acid 1092 in treatment
    • Schmidtke M, Hammerschmidt E, Schuler S et al. Susceptibility of coxsackievirus B3 laboratory strains and clinical isolates to the capsid function inhibitor pleconaril: antiviral studies with virus chimeras demonstrate the crucial role of amino acid 1092 in treatment. J. Antimicrob. Chemother. 56(4), 648-656 (2005).
    • (2005) J. Antimicrob. Chemother. , vol.56 , Issue.4 , pp. 648-656
    • Schmidtke, M.1    Hammerschmidt, E.2    Schuler, S.3
  • 16
    • 0036523703 scopus 로고    scopus 로고
    • Oral pleconaril treatment of picornavirus-associated viral respiratory illness in adults: Efficacy and tolerability in Phase II clinical trials
    • Hayden FG, Coats T, Kim K et al. Oral pleconaril treatment of picornavirus-associated viral respiratory illness in adults: efficacy and tolerability in Phase II clinical trials. Antivir. Ther. 7, 53-65 (2002).
    • (2002) Antivir. Ther. , vol.7 , pp. 53-65
    • Hayden, F.G.1    Coats, T.2    Kim, K.3
  • 17
    • 0038548251 scopus 로고    scopus 로고
    • Efficacy and safety of oral pleconaril for treatment of colds due to picornaviruses in adults: Results of 2 double-blind randomized placebo-controlled trials
    • Hayden FG, Herrington DT, Coats TL et al. Efficacy and safety of oral pleconaril for treatment of colds due to picornaviruses in adults: results of 2 double-blind, randomized, placebo-controlled trials. Clin. Infect. Dis. 36, 1523-1532 (2003).
    • (2003) Clin. Infect. Dis. , vol.36 , pp. 1523-1532
    • Hayden, F.G.1    Herrington, D.T.2    Coats, T.L.3
  • 19
    • 17444378657 scopus 로고    scopus 로고
    • Novel biphenyloxy propyl isoxazole derivatives for inhibition of human rhinovirus 2 and coxsackievirus B3 replication
    • Makarov VA, Riabova OB, Granik VG, Wutzler P, Schmidtke M. Novel [(biphenyloxy)propyl]isoxazole derivatives for inhibition of human rhinovirus 2 and coxsackievirus B3 replication. J. Antimicrob. Chemother. 55, 483-488 (2005).
    • (2005) J. Antimicrob. Chemother. , vol.55 , pp. 483-488
    • Makarov, V.A.1    Riabova, O.B.2    Granik, V.G.3    Wutzler, P.4    Schmidtke, M.5
  • 20
    • 34548133574 scopus 로고    scopus 로고
    • Quantitative structure-activity relationship studies of biphenyloxy propyl isoxazole derivatives-human rhinovirus 2 replication inhibitors
    • Kuzmin VE, Artemenko AG, Muratov EN et al. Quantitative structure-activity relationship studies of [(biphenyloxy)propyl] isoxazole derivatives - human rhinovirus 2 replication inhibitors. J. Med. Chem. 50, 4205-4213 (2007).
    • (2007) J. Med. Chem. , vol.50 , pp. 4205-4213
    • Kuzmin, V.E.1    Artemenko, A.G.2    Muratov, E.N.3
  • 21
    • 57249089067 scopus 로고    scopus 로고
    • New pleconaril and biphenyloxy propyl isoxazole derivatives with substitutions in the central ring exhibit antiviral activity against pleconaril-resistant coxsackievirus B3
    • Schmidtke M, Wutzler P, Zieger R, Riabova OB, Makarov VA. New pleconaril and [(biphenyloxy)propyl]isoxazole derivatives with substitutions in the central ring exhibit antiviral activity against pleconaril-resistant coxsackievirus B3. Antivir. Res. 81, 56-63 (2009).
    • (2009) Antivir. Res. , vol.81 , pp. 56-63
    • Schmidtke, M.1    Wutzler, P.2    Zieger, R.3    Riabova, O.B.4    Makarov, V.A.5
  • 22
    • 77954698582 scopus 로고    scopus 로고
    • HiT QSAR analysis of anti-coxsackievirus b3 activity of biphenyloxy propyl isoxazole derivatives
    • Muratov EN, Kuzmin VE, Artemenko AG et al. HiT QSAR analysis of anti-coxsackievirus b3 activity of [(biphenyloxy) propyl]isoxazole derivatives. Antivir. Res. 78, A60-A61 (2008).
    • (2008) Antivir. Res. , vol.78
    • Muratov, E.N.1    Kuzmin, V.E.2    Artemenko, A.G.3
  • 23
  • 24
    • 66149108476 scopus 로고    scopus 로고
    • QSAR analysis of antimicrobial activity of 4-thiazolidone derivatives
    • Artemenko AG, Muratov EN, Atamanyuk DV et al. QSAR analysis of antimicrobial activity of 4-thiazolidone derivatives. QSAR Comb. Sci. 29, 194-205 (2009).
    • (2009) QSAR Comb. Sci. , vol.29 , pp. 194-205
    • Artemenko, A.G.1    Muratov, E.N.2    Atamanyuk, D.V.3
  • 25
    • 34447542228 scopus 로고    scopus 로고
    • Identification of individual structural fragments of N,N-bis-5- nitropyrimidyl dispirotripiperazine derivatives for cytotoxicity and antiherpetic activity allows the prediction of new highly active compounds
    • Artemenko AG, Muratov EN, Kuzmin VE et al. Identification of individual structural fragments of N,N-(bis-5-nitropyrimidyl) dispirotripiperazine derivatives for cytotoxicity and antiherpetic activity allows the prediction of new highly active compounds. J. Antimicrob. Chemother. 60(1), 68-77 (2007).
    • (2007) J. Antimicrob. Chemother. , vol.60 , Issue.1 , pp. 68-77
    • Artemenko, A.G.1    Muratov, E.N.2    Kuzmin, V.E.3
  • 26
    • 46149119619 scopus 로고    scopus 로고
    • The effect of nitroaromatics composition on their toxicity in vivo: Novel efficient non-additive 1D QSAR analysis
    • Kuzmin VE, Muratov EN, Artemenko AG, Gorb LG, Qasim M, Leszczynski J. The effect of nitroaromatics composition on their toxicity in vivo: Novel, efficient non-additive 1D QSAR analysis. Chemosphere 72, 1373-1380 (2008).
    • (2008) Chemosphere , vol.72 , pp. 1373-1380
    • Kuzmin, V.E.1    Muratov, E.N.2    Artemenko, A.G.3    Gorb, L.G.4    Qasim, M.5    Leszczynski, J.6
  • 28
    • 67949106549 scopus 로고    scopus 로고
    • Consensus QSAR modeling of phosphor-containing chiral AChE inhibitors
    • Kuzmin VE, Muratov EN, Artemenko AG et al. Consensus QSAR modeling of phosphor-containing chiral AChE inhibitors. QSAR Comb. Sci. 28, 664-677 (2009).
    • (2009) QSAR Comb. Sci. , vol.28 , pp. 664-677
    • Kuzmin, V.E.1    Muratov, E.N.2    Artemenko, A.G.3
  • 29
    • 34447541438 scopus 로고    scopus 로고
    • Investigation of anti-influenza activity using hierarchic QSAR technology on the base of simplex representation of molecular structure
    • Muratov EN, Artemenko AG, Kuzmin VE et al. Investigation of anti-influenza activity using hierarchic QSAR technology on the base of simplex representation of molecular structure. Antivir. Res. 65(3), A62-A63 (2005).
    • (2005) Antivir. Res. , vol.65 , Issue.3
    • Muratov, E.N.1    Artemenko, A.G.2    Kuzmin, V.E.3
  • 30
    • 0036043740 scopus 로고    scopus 로고
    • The analysis of structure- anticancer and antiviral activity relationships for macrocyclic pyridinophanes and their analogues on the basis of 4D QSAR models simplex representation of molecular structure
    • Kuzmin VE, Artemenko AG, Lozitsky VP et al. The analysis of structure- anticancer and antiviral activity relationships for macrocyclic pyridinophanes and their analogues on the basis of 4D QSAR models (simplex representation of molecular structure). Acta Biochim. Polon. 49, 157-168 (2002).
    • (2002) Acta Biochim. Polon. , vol.49 , pp. 157-168
    • Kuzmin, V.E.1    Artemenko, A.G.2    Lozitsky, V.P.3
  • 31
    • 44249116058 scopus 로고    scopus 로고
    • Hierarchical QSAR technology on the base of simplex representation of molecular structure
    • Kuzmin VE, Artemenko AG, Muratov EN. Hierarchical QSAR technology on the base of Simplex representation of molecular structure. J. Comp. Aid. Mol. Des. 22, 403-421 (2008).
    • (2008) J. Comp. Aid. Mol. Des. , vol.22 , pp. 403-421
    • Kuzmin, V.E.1    Artemenko, A.G.2    Muratov, E.N.3
  • 32
    • 0031084988 scopus 로고    scopus 로고
    • GA strategy for variable selection in QSAR studies: GA-based PLS analysis of calcium channel antagonists
    • Hasegawa K, Miyashita Y, Funatsu K. GA strategy for variable selection in QSAR studies: GA-based PLS analysis of calcium channel antagonists. J. Chem. Inf. Comput. Sci. 37, 306-310 (1997).
    • (1997) J. Chem. Inf. Comput. Sci. , vol.37 , pp. 306-310
    • Hasegawa, K.1    Miyashita, Y.2    Funatsu, K.3
  • 33
    • 33845379303 scopus 로고
    • Atom pairs as molecular features in structure-activity studies definition and application
    • Carhart RE, Smith DH, Venkataraghavan R. Atom pairs as molecular features in structure-activity studies. Definition and application. J. Chem. Inf. Comput. Sci. 25, 64-73 (1995).
    • (1995) J. Chem. Inf. Comput. Sci. , vol.25 , pp. 64-73
    • Carhart, R.E.1    Smith, D.H.2    Venkataraghavan, R.3
  • 34
    • 84984336225 scopus 로고
    • Interactive variable selection IVS for PLS part 1: Theory and algorithms
    • Lindgren F, Geladi P, Rannar S, Wold S. Interactive variable selection (IVS) for PLS. Part 1: theory and algorithms. J. Chemometr. 8, 349-363 (1994).
    • (1994) J. Chemometr. , vol.8 , pp. 349-363
    • Lindgren, F.1    Geladi, P.2    Rannar, S.3    Wold, S.4
  • 35
    • 0000626789 scopus 로고    scopus 로고
    • Evolutionary variable selection in regression and PLS analyses
    • Kubinyi H. Evolutionary variable selection in regression and PLS analyses. J. Chemometr. 10, 119-133 (1996).
    • (1996) J. Chemometr. , vol.10 , pp. 119-133
    • Kubinyi, H.1
  • 36
    • 77956964002 scopus 로고    scopus 로고
    • Best practices for QSAR model development validation and exploitation
    • Tropsha A. Best practices for QSAR model development, validation, and exploitation. Mol. Inf. 29, 476-488 (2010).
    • (2010) Mol. Inf. , vol.29 , pp. 476-488
    • Tropsha, A.1
  • 37
    • 36949022890 scopus 로고    scopus 로고
    • Predictive QSAR modeling workflow model applicability domains and virtual screening
    • Tropsha A, Golbraikh A. Predictive QSAR modeling workflow model applicability domains and virtual screening. Curr. Pharm. Des. 13, 3494-3504 (2007).
    • (2007) Curr. Pharm. Des. , vol.13 , pp. 3494-3504
    • Tropsha, A.1    Golbraikh, A.2
  • 38
    • 0038724207 scopus 로고    scopus 로고
    • The importance of being earnest: Validation is the absolute essential for successful application and interpretation of QSPR models
    • Tropsha A, Gramatica P, Gombar V. The importance of being earnest: validation is the absolute essential for successful application and interpretation of QSPR models. QSAR Comb. Sci. 22, 69-77 (2003).
    • (2003) QSAR Comb. Sci. , vol.22 , pp. 69-77
    • Tropsha, A.1    Gramatica, P.2    Gombar, V.3
  • 39
    • 27744590591 scopus 로고    scopus 로고
    • QSAR applicability domain estimation by projection of the training set in descriptor space: A review
    • Jaworska J, Nikolova-Jeliazkova N, Aldenberg T. QSAR applicability domain estimation by projection of the training set in descriptor space: a review. Altern. Lab. Anim. 33, 445-459 (2005).
    • (2005) Altern. Lab. Anim. , vol.33 , pp. 445-459
    • Jaworska, J.1    Nikolova-Jeliazkova, N.2    Aldenberg, T.3
  • 40
    • 77954700753 scopus 로고    scopus 로고
    • Per aspera ad astra: Application of simplex QSAR approach in antiviral research
    • Muratov EN, Artemenko AG, Varlamova EV et al. Per aspera ad astra: application of Simplex QSAR approach in antiviral research. Future Med. Chem. 2, 1205-1226 (2010).
    • (2010) Future Med. Chem. , vol.2 , pp. 1205-1226
    • Muratov, E.N.1    Artemenko, A.G.2    Varlamova, E.V.3
  • 42
    • 0035002220 scopus 로고    scopus 로고
    • A rapid assay for evaluation of antiviral activity against coxsackie virus B3 influenza virus A and herpes simplex virus type 1
    • Schmidtke M, Schnittler U, Jahn B, Dahse H, Stelzner A. A rapid assay for evaluation of antiviral activity against coxsackie virus B3, influenza virus A, and herpes simplex virus type 1. J. Virol. Methods 95, 133-143 (2001).
    • (2001) J. Virol. Methods , vol.95 , pp. 133-143
    • Schmidtke, M.1    Schnittler, U.2    Jahn, B.3    Dahse, H.4    Stelzner, A.5
  • 43
    • 84984286248 scopus 로고
    • A PLS kernel algorithm for data sets with many variables and fewer objects part 1: Theory and algorithm
    • Rannar S, Lindgren F, Geladi P, Wold S. A PLS kernel algorithm for data sets with many variables and fewer objects. Part 1: theory and algorithm. J. Chemometr. 8, 111-125 (1994).
    • (1994) J. Chemometr. , vol.8 , pp. 111-125
    • Rannar, S.1    Lindgren, F.2    Geladi, P.3    Wold, S.4
  • 44
    • 18144415506 scopus 로고    scopus 로고
    • Investigation of anticancer activity of macrocyclic schiff bases by means of 4D-QSAR based on simplex representation of molecular structure
    • Kuzmin VE, Artemenko AG, Lozitska RN et al. Investigation of anticancer activity of macrocyclic Schiff bases by means of 4D-QSAR based on simplex representation of molecular structure. SAR QSAR Environ. Res. 16(3), 219-230 (2005).
    • (2005) SAR QSAR Environ. Res. , vol.16 , Issue.3 , pp. 219-230
    • Kuzmin, V.E.1    Artemenko, A.G.2    Lozitska, R.N.3
  • 45
    • 33846833802 scopus 로고    scopus 로고
    • Understanding human rhinovirus infections in terms of QSAR
    • Verma RP, Hansch C. Understanding human rhinovirus infections in terms of QSAR. Virology 359(1), 152-161 (2007).
    • (2007) Virology , vol.359 , Issue.1 , pp. 152-161
    • Verma, R.P.1    Hansch, C.2
  • 46
    • 77954741203 scopus 로고    scopus 로고
    • QSAR analysis of anti-coxsackievirus B3 nancy activity of 2-amino-3- nitropyrazole 1 5 - A pyrimidines by means of simplex approach
    • Kuzmin VE, Artemenko AG, Muratov EN et al. QSAR analysis of anti-coxsackievirus B3 nancy activity of 2-amino-3- nitropyrazole[1,5-a] pyrimidines by means of Simplex approach. Antivir. Res. 74, A49-A50 (2007).
    • (2007) Antivir. Res. , vol.74
    • Kuzmin, V.E.1    Artemenko, A.G.2    Muratov, E.N.3
  • 47
    • 78049349961 scopus 로고    scopus 로고
    • Trust but verify: On the importance of chemical structure curation in cheminformatics and QSAR modeling research
    • Fourches D, Muratov EN, Tropsha A. Trust, but verify: on the importance of chemical structure curation in cheminformatics and QSAR modeling research. J. Chem. Inf. Model. 50, 1189-1204 (2010).
    • (2010) J. Chem. Inf. Model. , vol.50 , pp. 1189-1204
    • Fourches, D.1    Muratov, E.N.2    Tropsha, A.3
  • 48
    • 70449634957 scopus 로고    scopus 로고
    • Predicting new molecular targets for known drugs
    • Keiser MJ, Setola V, Irwin JJ et al. Predicting new molecular targets for known drugs. Nature 262, 175-182 (2009).
    • (2009) Nature , vol.262 , pp. 175-182
    • Keiser, M.J.1    Setola, V.2    Irwin, J.J.3


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