메뉴 건너뛰기




Volumn 19, Issue 9, 2010, Pages 1273-1286

Use of structure-based virtual screening in the investigation of novel human sialidase inhibitors

Author keywords

Docking; Inhibitor design; Sialic acid; Sialidase; Virtual screening

Indexed keywords

2 DEOXY 2,3 DEHYDRO I ACETYLNEURAMINIC ACID; DICARBOXYLIC ACID; FURAN; GSC 649; GSC 672; GSC 697; SIALIDASE; SIALIDASE INHIBITOR; UNCLASSIFIED DRUG;

EID: 78650177875     PISSN: 10542523     EISSN: None     Source Type: Journal    
DOI: 10.1007/s00044-009-9269-6     Document Type: Article
Times cited : (2)

References (24)
  • 1
    • 0035047041 scopus 로고    scopus 로고
    • Comparative enzymology, biochemistry and pathophysiology of human exo-α-sialidases (neuraminidases)
    • DOI 10.1016/S1096-4959(01)00372-4, PII S1096495901003724
    • KE Achyuthan AM Achyuthan 2001 Comparative enzymology, biochemistry and pathophysiology of human exo-alpha-sialidases (neuraminidases) Comp Biochem Physiol B Biochem Mol Biol 129 29 64 1:STN:280:DC%2BD3MvkvVCksQ%3D%3D 10.1016/S1096-4959(01)00372-4 11337249 (Pubitemid 32401124)
    • (2001) Comparative Biochemistry and Physiology - B Biochemistry and Molecular Biology , vol.129 , Issue.1 , pp. 29-64
    • Achyuthan, K.E.1    Achyuthan, A.M.2
  • 2
    • 12844253114 scopus 로고    scopus 로고
    • Crystal structure of the human cytosolic sialidase Neu2. Evidence for the dynamic nature of substrate recognition
    • 1:CAS:528:DC%2BD2cXhtFGgu7nP 15501818
    • LM Chavas C Tringali P Fusi B Venerando G Tettamanti R Kato E Monti S Wakatsuki 2005 Crystal structure of the human cytosolic sialidase Neu2. Evidence for the dynamic nature of substrate recognition J Biol Chem 280 469 475 1:CAS:528:DC%2BD2cXhtFGgu7nP 15501818
    • (2005) J Biol Chem , vol.280 , pp. 469-475
    • Chavas, L.M.1    Tringali, C.2    Fusi, P.3    Venerando, B.4    Tettamanti, G.5    Kato, R.6    Monti, E.7    Wakatsuki, S.8
  • 6
    • 38149093137 scopus 로고    scopus 로고
    • PO22-699: Prevention of atherosclerosis in apoe knockout mice using sialidase inhibitors: A new class of anti-atherogenic drugs
    • 10.1016/S1567-5688(07)71709-9
    • SA Igdoura A Yang D DeSA BL Trigatti 2007 PO22-699: prevention of atherosclerosis in apoe knockout mice using sialidase inhibitors: a new class of anti-atherogenic drugs Athero Suppl 8 187 10.1016/S1567-5688(07)71709-9
    • (2007) Athero Suppl , vol.8 , pp. 187
    • Igdoura, S.A.1    Yang, A.2    Desa, D.3    Trigatti, B.L.4
  • 7
    • 13844312649 scopus 로고    scopus 로고
    • ZINC - A free database of commercially available compounds for virtual screening
    • DOI 10.1021/ci049714+
    • JJ Irwin BK Shoichet 2005 ZINC, a free database of commercially available compounds for virtual screening J Chem Inf Model 45 177 182 1:CAS:528:DC%2BD2cXhtVOjt77J 10.1021/ci049714+ 15667143 (Pubitemid 40736970)
    • (2005) Journal of Chemical Information and Modeling , vol.45 , Issue.1 , pp. 177-182
    • Irwin, J.J.1    Shoichet, B.K.2
  • 8
    • 8844263008 scopus 로고    scopus 로고
    • Docking and scoring in virtual screening for drug discovery: Methods and applications
    • DOI 10.1038/nrd1549
    • DB Kitchen H Decornez JR Furr J Bajorth 2004 Docking and scoring in virtual screening for drug discovery: methods and applications Nat Rev Drug Discov 3 935 949 1:CAS:528:DC%2BD2cXptFemtrg%3D 10.1038/nrd1549 15520816 (Pubitemid 39529931)
    • (2004) Nature Reviews Drug Discovery , vol.3 , Issue.11 , pp. 935-949
    • Kitchen, D.B.1    Decornez, H.2    Furr, J.R.3    Bajorath, J.4
  • 9
    • 33748424710 scopus 로고    scopus 로고
    • Homology modeling of human sialidase enzymes NEU1, NEU3 and NEU4 based on the crystal structure of NEU2: Hints for the design of selective NEU3 inhibitors
    • DOI 10.1016/j.jmgm.2005.12.006, PII S1093326305001749
    • S Magesh T Suzuki T Miyagi H Ishida M Kiso 2006 Homology modeling of human sialidase enzymes NEU1, NEU3 and NEU4 based on the crystal structure of NEU2: hints for the design of selective NEU3 inhibitors J Mol Graph Model 25 196 207 1:CAS:528:DC%2BD28Xps1Gis78%3D 10.1016/j.jmgm.2005.12.006 16427342 (Pubitemid 44345275)
    • (2006) Journal of Molecular Graphics and Modelling , vol.25 , Issue.2 , pp. 196-207
    • Magesh, S.1    Suzuki, T.2    Miyagi, T.3    Ishida, H.4    Kiso, M.5
  • 10
    • 38149137280 scopus 로고    scopus 로고
    • Design, synthesis, and biological evaluation of human sialidase inhibitors. Part 1: Selective inhibitors of lysosomal sialidase (NEU1)
    • 1:CAS:528:DC%2BD1cXosFWgtQ%3D%3D 10.1016/j.bmcl.2007.11.084 18068975
    • S Magesh S Moriya T Suzuki T Miyagi H Ishida M Kiso 2008 Design, synthesis, and biological evaluation of human sialidase inhibitors. Part 1: Selective inhibitors of lysosomal sialidase (NEU1) Bioorg Med Chem Lett 18 532 537 1:CAS:528:DC%2BD1cXosFWgtQ%3D%3D 10.1016/j.bmcl.2007.11.084 18068975
    • (2008) Bioorg Med Chem Lett , vol.18 , pp. 532-537
    • Magesh, S.1    Moriya, S.2    Suzuki, T.3    Miyagi, T.4    Ishida, H.5    Kiso, M.6
  • 11
    • 66449108124 scopus 로고    scopus 로고
    • Human sialidase inhibitors: Design, synthesis, and biological evaluation of 4-acetamido-5-acylamido-2-fluoro benzoic acids
    • 1:CAS:528:DC%2BD1MXnt1Gqs7Y%3D 10.1016/j.bmc.2009.04.065 19450982
    • S Magesh S Moriya T Suzuki T Miyagi H Ishida M Kiso 2009 Human sialidase inhibitors: design, synthesis, and biological evaluation of 4-acetamido-5- acylamido-2-fluoro benzoic acids Bioorg Med Chem 17 4595 4603 1:CAS:528:DC%2BD1MXnt1Gqs7Y%3D 10.1016/j.bmc.2009.04.065 19450982
    • (2009) Bioorg Med Chem , vol.17 , pp. 4595-4603
    • Magesh, S.1    Moriya, S.2    Suzuki, T.3    Miyagi, T.4    Ishida, H.5    Kiso, M.6
  • 12
    • 31044444908 scopus 로고    scopus 로고
    • Modelling, synthesis and biological evaluation of novel glucuronide-based probes of Vibrio cholerae sialidase
    • DOI 10.1016/j.bmc.2005.10.004, PII S0968089605009533
    • MC Mann R Thomson JC Dyason S McAtamney M von Itzstein 2006 Modelling, synthesis and biological evaluation of novel glucuronide-based probes of Vibrio cholerae sialidase Bioorg Med Chem 14 1518 1537 1:CAS:528:DC%2BD28XmsVGiuw%3D%3D 10.1016/j.bmc.2005.10.004 16275104 (Pubitemid 43120288)
    • (2006) Bioorganic and Medicinal Chemistry , vol.14 , Issue.5 , pp. 1518-1537
    • Mann, M.C.1    Thomson, R.J.2    Dyason, J.C.3    McAtamney, S.4    Von Itzstein, M.5
  • 13
    • 84996557694 scopus 로고    scopus 로고
    • J. Kamerling G-J Boons Y. Lee A. Suzuki N. Taniguchi A.G.J. Voragen (eds). Elsevier Oxford
    • Miyagi T, Yamaguchi K (2008) In: Kamerling J, Boons G-J, Lee Y, Suzuki A, Taniguchi N, Voragen AGJ (eds) Comprehensive glycoscience, from chemistry to biology, vol 3. Elsevier, Oxford, pp 297-323
    • (2008) Comprehensive Glycoscience, from Chemistry to Biology , vol.3 , pp. 297-323
    • Miyagi, T.1    Yamaguchi, K.2
  • 14
    • 12344309880 scopus 로고    scopus 로고
    • Aberrant expression of sialidase in cancer
    • 1:CAS:528:DC%2BD2MXhsFajtbs%3D
    • T Miyagi K Kato S Ueno T Wada 2004 Aberrant expression of sialidase in cancer Trends Glycosci Glycotechnol 16 371 381 1:CAS:528:DC%2BD2MXhsFajtbs%3D
    • (2004) Trends Glycosci Glycotechnol , vol.16 , pp. 371-381
    • Miyagi, T.1    Kato, K.2    Ueno, S.3    Wada, T.4
  • 15
    • 3543071604 scopus 로고    scopus 로고
    • Sialidase and malignancy: A minireview
    • 1:CAS:528:DC%2BD2cXjtFKqtr8%3D 10.1023/B:GLYC.0000024250.48506.bf 15090732
    • T Miyagi T Wada K Yamaguchi K Hata 2004 Sialidase and malignancy: a minireview Glycoconj J 20 189 198 1:CAS:528:DC%2BD2cXjtFKqtr8%3D 10.1023/B:GLYC.0000024250.48506.bf 15090732
    • (2004) Glycoconj J , vol.20 , pp. 189-198
    • Miyagi, T.1    Wada, T.2    Yamaguchi, K.3    Hata, K.4
  • 18
    • 0001171474 scopus 로고
    • A. Rosenburg (eds). Plenum Press New York
    • Saito M, Yu RK (1995) In: Rosenburg A (ed) Biology of the sialic acids. Plenum Press, New York, pp 261-314
    • (1995) Biology of the Sialic Acids , pp. 261-314
    • Saito, M.1    Yu, R.K.2
  • 20
    • 0022340485 scopus 로고
    • Sialic acids and their role as biological masks
    • DOI 10.1016/0968-0004(85)90112-4
    • R Schauer 1985 Sialic acids and their role as biological masks Trends Biochem Sci 10 357 360 1:CAS:528:DyaL2MXlslCju7c%3D 10.1016/0968-0004(85)90112-4 (Pubitemid 16220327)
    • (1985) Trends in Biochemical Sciences , vol.10 , Issue.9 , pp. 357-360
    • Schauer, R.1
  • 21
    • 0034444960 scopus 로고    scopus 로고
    • Achievements and challenges of sialic acid research
    • DOI 10.1023/A:1011062223612
    • R Schauer 2000 Achievements and challenges of sialic acid research Glycoconj J 17 485 499 1:CAS:528:DC%2BD3MXksVOgtL8%3D 10.1023/A:1011062223612 11421344 (Pubitemid 32480340)
    • (2000) Glycoconjugate Journal , vol.17 , Issue.7-9 , pp. 485-499
    • Schauer, R.1
  • 23
    • 0037212102 scopus 로고    scopus 로고
    • LigandFit: A novel method for the shape-directed rapid docking of ligands to protein active sites
    • DOI 10.1016/S1093-3263(02)00164-X, PII S109332630200164X
    • CM Venkatachalam X Jiang T Oldfield M Waldman 2003 LigandFit: a novel method for the shape-directed rapid docking of ligands to protein active sites J Mol Graph Model 21 289 307 1:CAS:528:DC%2BD38XptlWmuro%3D 10.1016/S1093- 3263(02)00164-X 12479928 (Pubitemid 35441326)
    • (2003) Journal of Molecular Graphics and Modelling , vol.21 , Issue.4 , pp. 289-307
    • Venkatachalam, C.M.1    Jiang, X.2    Oldfield, T.3    Waldman, M.4


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.