메뉴 건너뛰기




Volumn 17, Issue 3, 2010, Pages 332-339

3D pharmacophore based virtual screening of A2A adenosine receptor antagonists

Author keywords

A2a; Adenosine receptor antagonists; Docking; Pharmacophore based virtual library screening

Indexed keywords

ADENOSINE A2A RECEPTOR; ENZYME INHIBITOR; TRIAZOLE DERIVATIVE;

EID: 77949955149     PISSN: 09298665     EISSN: None     Source Type: Journal    
DOI: 10.2174/092986610790780260     Document Type: Article
Times cited : (7)

References (55)
  • 1
    • 0035209620 scopus 로고    scopus 로고
    • International union of pharmacology. XXV. nomenclature and classification of adenosine receptors
    • Fredholm, B. B.; IJzerman A. P.; Jacobson, K. A.; Klotz, K.-A.; Linden, J. International union of pharmacology. XXV. nomenclature and classification of adenosine receptors. Pharmacol. Rev., 2001, 53(4), 527-552.
    • (2001) Pharmacol , vol.53 , Issue.4 , pp. 527-552
    • Fredholm, B.B.1    Ijzerman, A.P.2    Jacobson, K.A.3    Klotz, K.-A.4    Linden, J.5
  • 2
    • 0034893151 scopus 로고    scopus 로고
    • Role of cyclic nucleotides in vasodilatations of the rat thoracic aorta induced by adenosine analogues
    • Hourani S. M.; Boon, K.; Fooks, H. M.; Prentice, D. J. Role of cyclic nucleotides in vasodilatations of the rat thoracic aorta induced by adenosine analogues. Br. J. Pharmacol., 2001, 133(6), 833-840.
    • (2001) Br. J. Pharmacol , vol.133 , Issue.6 , pp. 833-840
    • Hourani, S.M.1    Boon, K.2    Fooks, H.M.3    Prentice, D.J.4
  • 3
    • 26444445618 scopus 로고    scopus 로고
    • New therapies for the treatment of Parkinson's disease: Adenosine A2A receptor antagonists
    • Pinna, A.; Wardas, J.; Simola, N.; Morelli, M. New therapies for the treatment of Parkinson's disease: Adenosine A2A receptor antagonists. Life Sci., 2005, 77(26), 3259-3267.
    • (2005) Life Sci , vol.77 , Issue.26 , pp. 3259-3267
    • Pinna, A.1    Wardas, J.2    Simola, N.3    Morelli, M.4
  • 4
    • 2542432162 scopus 로고    scopus 로고
    • Physiological control of immune response and inflammatory tissue damage by hypoxia inducible factors and adenosine A2A receptors
    • Sitkovsky, M. V. Physiological control of immune response and inflammatory tissue damage by hypoxia inducible factors and adenosine A2A receptors. Annu. Rev. Immunol., 2004, 22, 2101-2126.
    • (2004) Annu. Rev. Immunol , vol.22 , pp. 2101-2126
    • Sitkovsky, M.V.1
  • 5
    • 25444454359 scopus 로고    scopus 로고
    • Regulation of immune cells by local-tissue oxygen tension: HIF1 and adenosine receptors
    • Sitkovsky, M.; Lukashev, D. Regulation of immune cells by local-tissue oxygen tension: HIF1 and adenosine receptors. Nat. Rev. Immunol., 2005a, 5(9), 712-721.
    • (2005) Nat. Rev. Immunol , vol.5 , Issue.9 , pp. 712-721
    • Sitkovsky, M.1    Lukashev, D.2
  • 7
    • 0344052684 scopus 로고    scopus 로고
    • Antiparkinsonian effect of a new selective adenosine A2A receptor antagonist in MPTP-treated monkeys
    • Grondin, R.; Bedard, P. J.; Hadj Tahar, A.; Gregoire, L.; Mori, A.; Kase, H. Antiparkinsonian effect of a new selective adenosine A2A receptor antagonist in MPTP-treated monkeys. Am. Acad. Neurol., 1999, 52(8), 1673-1677.
    • (1999) Am. Acad. Neurol , vol.52 , Issue.8 , pp. 1673-1677
    • Grondin, R.1    Bedard, P.J.2    Hadj Tahar, A.3    Gregoire, L.4    Mori, A.5    Kase, H.6
  • 8
    • 40349091377 scopus 로고    scopus 로고
    • Adenosine A2A receptor antagonists: Blockade of adenosinergic effects and T regulatory cells
    • Sitkovsky, M.; Lukashev, D.; Deaglio, S.; Dwyer, K.; Robson, S. C.; Ohta, A. Adenosine A2A receptor antagonists: Blockade of adenosinergic effects and T regulatory cells. Br. J. Pharmacol., 2008, 153(S1), S457-S464.
    • (2008) Br. J. Pharmacol , vol.153 , Issue.S1
    • Sitkovsky, M.1    Lukashev, D.2    Deaglio, S.3    Dwyer, K.4    Robson, S.C.5    Ohta, A.6
  • 9
    • 0033118334 scopus 로고    scopus 로고
    • Molecular tinkering of G protein-coupled receptors
    • Bockaert, J.; Pin, J. P. Molecular tinkering of G protein-coupled receptors: An evolutionary success. EMBO J., 1999, 18(7), 1723-1729.
    • (1999) An Evolutionary Success. Embo J , vol.18 , Issue.7 , pp. 1723-1729
    • Bockaert, J.1    Pin, J.P.2
  • 10
    • 1842856369 scopus 로고    scopus 로고
    • Molecular modeling the human A1 adenosine receptor and study of the mechanisms of its selective ligand binding
    • Ivanov, A. A.; Baskin, I. I.; Palyulin; V. A.; Zefirov, N. S. Molecular modeling the human A1 adenosine receptor and study of the mechanisms of its selective ligand binding. Dokl. Biochem. Bio-phys., 2002, 386(4), 271-274.
    • (2002) Dokl. Biochem. Bio-phys , vol.386 , Issue.4 , pp. 271-274
    • Ivanov, A.A.1    Baskin, I.I.2    Palyulin3    , V.A.4    Zefirov, N.S.5
  • 12
    • 27444442315 scopus 로고    scopus 로고
    • Molecular modeling and molecular dynamics simulation of the human A2B adenosine receptor. The study of the possible binding modes of the A2B receptor antagonists
    • Ivanov, A. A.; Baskin, I. I.; Palyulin, V. A.; Piccagli, L.; Baraldi, P. G.; Zefirov, N. S. Molecular modeling and molecular dynamics simulation of the human A2B adenosine receptor. The study of the possible binding modes of the A2B receptor antagonists. J. Med. Chem., 2005, 48(22), 6813-6820.
    • (2005) J. Med. Chem , vol.48 , Issue.22 , pp. 6813-6820
    • Ivanov, A.A.1    Baskin, I.I.2    Palyulin, V.A.3    Piccagli, L.4    Baraldi, P.G.5    Zefirov, N.S.6
  • 13
    • 11144241002 scopus 로고    scopus 로고
    • Techniques: Recent developments in computer-aided engineering of GPCR ligands using the human adenosine A3 receptor as an example
    • Stefano, M.; Giampiero, S.; Kenneth, A. J. Techniques: Recent developments in computer-aided engineering of GPCR ligands using the human adenosine A3 receptor as an example. Trends Pharmacol. Sci., 2005, 26(1), 44-51.
    • (2005) Trends Pharmacol. Sci , vol.26 , Issue.1 , pp. 44-51
    • Stefano, M.1    Giampiero, S.2    Kenneth, A.J.3
  • 14
    • 39449105071 scopus 로고    scopus 로고
    • Cell-PLoc: A package of web-servers for predicting subcellular localization of proteins in various organisms
    • Chou, K. C.; Shen, H. B. Cell-PLoc: A package of web-servers for predicting subcellular localization of proteins in various organisms. Nat. Protocols, 2008, 3(2), 153-162.
    • (2008) Nat. Protocols , vol.3 , Issue.2 , pp. 153-162
    • Chou, K.C.1    Shen, H.B.2
  • 15
    • 34548606295 scopus 로고    scopus 로고
    • Review: Recent progresses in protein subcellular location prediction
    • Chou, K. C.; Shen, H. B. Review: Recent progresses in protein subcellular location prediction. Anal. Biochem., 2007, 370(1), 1-16.
    • (2007) Anal. Biochem , vol.370 , Issue.1 , pp. 1-16
    • Chou, K.C.1    Shen, H.B.2
  • 16
    • 34249318001 scopus 로고    scopus 로고
    • Euk-mPLoc: A fusion classifier for large-scale eukaryotic protein subcellular location rediction by incorporating multiple sites
    • Chou, K. C.; Shen, H. B. Euk-mPLoc: a fusion classifier for large-scale eukaryotic protein subcellular location rediction by incorporating multiple sites. J. Proteome Res., 2007, 6(5), 1728-1734.
    • (2007) J. Proteome Res , vol.6 , Issue.5 , pp. 1728-1734
    • Chou, K.C.1    Shen, H.B.2
  • 17
    • 65249148484 scopus 로고    scopus 로고
    • QuatIdent: A web server for identifying protein quaternary structural attribute by fusing functional domain and sequential evolution information
    • Shen, H. B.; Chou, K. C. QuatIdent: A web server for identifying protein quaternary structural attribute by fusing functional domain and sequential evolution information. J. Proteome Res., 2009, 8(3), 1577-1584.
    • (2009) J. Proteome Res , vol.8 , Issue.3 , pp. 1577-1584
    • Shen, H.B.1    Chou, K.C.2
  • 18
    • 62649087986 scopus 로고    scopus 로고
    • Predicting protein quaternary structural attribute by hybridizing functional domain composition and pseudo amino acid composition
    • Xiao, X.; Wang, P.; Chou, K. C. Predicting protein quaternary structural attribute by hybridizing functional domain composition and pseudo amino acid composition. J. Appl. Cryst., 2009, 42(2), 169-173.
    • (2009) J. Appl. Cryst , vol.42 , Issue.2 , pp. 169-173
    • Xiao, X.1    Wang, P.2    Chou, K.C.3
  • 19
    • 64749096548 scopus 로고    scopus 로고
    • GPCR-CA: A cellular automaton image approach for predicting G-protein-coupled receptor functional classes
    • Xiao, X.; Wang, P.; Chou, K. C. GPCR-CA: A cellular automaton image approach for predicting G-protein-coupled receptor functional classes. J. Comput. Chem., 2009, 30(9), 1414-1423.
    • (2009) J. Comput. Chem , vol.30 , Issue.9 , pp. 1414-1423
    • Xiao, X.1    Wang, P.2    Chou K., C.3
  • 20
    • 53149132374 scopus 로고    scopus 로고
    • ProtIdent: A web server for identifying proteases and their types by fusing functional domain and sequential evolution information
    • Chou, K. C.; Shen, H. B. ProtIdent: A web server for identifying proteases and their types by fusing functional domain and sequential evolution information. Biochem. Biophys. Res. Commun., 2008, 376(2), 321-325.
    • (2008) Biochem. Biophys. Res. Commun , vol.376 , Issue.2 , pp. 321-325
    • Chou, K.C.1    Shen, H.B.2
  • 21
    • 57749188687 scopus 로고    scopus 로고
    • Identification of proteases and their types
    • Shen, H. B.; Chou, K. C. Identification of proteases and their types. Anal. Biochem., 2009, 385(1), 153-160.
    • (2009) Anal. Biochem , vol.385 , Issue.1 , pp. 153-160
    • Shen, H.B.1    Chou, K.C.2
  • 22
    • 0027219970 scopus 로고
    • A vectorized sequence-coupling model for predicting HIV protease cleavage sites in proteins
    • Chou, K. C. A vectorized sequence-coupling model for predicting HIV protease cleavage sites in proteins. J. Biol. Chem., 1993, 268(23), 16938-16948.
    • (1993) J. Biol. Chem , vol.268 , Issue.23 , pp. 16938-16948
    • Chou, K.C.1
  • 23
    • 0030049315 scopus 로고    scopus 로고
    • Review: Prediction of HIV protease cleavage sites in proteins
    • Chou, K. C. Review: Prediction of HIV protease cleavage sites in proteins. Anal. Biochem., 1996, 233(1), 1-14.
    • (1996) Anal. Biochem , vol.233 , Issue.1 , pp. 1-14
    • Chou, K.C.1
  • 24
    • 40649104302 scopus 로고    scopus 로고
    • HIVcleave: A web-server for predicting HIV protease cleavage sites in proteins
    • Shen, H.B; Chou, K. C. HIVcleave: a web-server for predicting HIV protease cleavage sites in proteins. Anal. Biochem., 2008, 375(2), 388-390.
    • (2008) Anal. Biochem , vol.375 , Issue.2 , pp. 388-390
    • Shen, H.B.1    Chou, K.C.2
  • 25
    • 34247544233 scopus 로고    scopus 로고
    • Signal-CF: A subsite-coupled and window-fusing approach for predicting signal peptides
    • Chou, K. C.; Shen, H. B. Signal-CF: a subsite-coupled and window-fusing approach for predicting signal peptides. Biochem. Bio-phys. Res. Commun., 2007, 357(3), 633-640.
    • (2007) Biochem. Bio-phys. Res. Commun , vol.357 , Issue.3 , pp. 633-640
    • Chou, K.C.1    Shen, H.B.2
  • 26
    • 34748902270 scopus 로고    scopus 로고
    • Signal-3L: A 3-layer approach for predicting signal peptide
    • Shen, H. B.; Chou, K. C. Signal-3L: a 3-layer approach for predicting signal peptide. Biochem. Biophys. Res. Commun., 2007, 363(2), 297-303.
    • (2007) Biochem. Biophys. Res. Commun , vol.363 , Issue.2 , pp. 297-303
    • Shen, H.B.1    Chou, K.C.2
  • 27
    • 47349088078 scopus 로고    scopus 로고
    • Review: Recent advances in QSAR and their applications in predicting the activities of chemical molecules, peptides and proteins for drug design
    • Du, Q.S.; Huang, R.B.; Chou, K. C. Review: Recent advances in QSAR and their applications in predicting the activities of chemical molecules, peptides and proteins for drug design. Curr. Protein Pept. Sci., 2008, 9(3), 248-259.
    • (2008) Curr. Protein Pept. Sci , vol.9 , Issue.3 , pp. 248-259
    • Du, Q.S.1    Huang, R.B.2    Chou, K.C.3
  • 28
    • 58249089596 scopus 로고    scopus 로고
    • Fragment-based quantitative structure-activity relationship (FB-QSAR) for fragment-based drug design
    • Du, Q.S.; Huang, R.B.; Wei, Y.T.; Pang, Z.W.; Du, L.Q.; Chou, K. C. Fragment-based quantitative structure-activity relationship (FB-QSAR) for fragment-based drug design. J. Comput. Chem., 2009, 30(2), 295-304.
    • (2009) J. Comput. Chem , vol.30 , Issue.2 , pp. 295-304
    • Du, Q.S.1    Huang, R.B.2    Wei, Y.T.3    Pang, Z.W.4    Du, L.Q.5    Chou, K.C.6
  • 29
    • 44449088493 scopus 로고    scopus 로고
    • Unified Q.S.A.R.approach to antimicrobials. Part 3: First multi-tasking QSAR model for Input-Coded prediction, structural back-projection, and complex networks clustering of antiprotozoal compounds
    • Prado-Prado, F.J.; Gonzalez-Diaz, H.; de la Vega, O.M.; Ubeira, F.M.; Chou, K. C. Unified QSAR approach to antimicrobials. Part 3: First multi-tasking QSAR model for Input-Coded prediction, structural back-projection, and complex networks clustering of antiprotozoal compounds. Bioorg. Med. Chem., 2008, 16(11), 5871-5880.
    • (2008) Bioorg. Med. Chem , vol.16 , Issue.11 , pp. 5871-5880
    • Prado-Prado, F.J.1    Gonzalez-Diaz, H.2    de la Vega, O.M.3    Ubeira, F.M.4    Chou, K.C.5
  • 30
    • 58749107670 scopus 로고    scopus 로고
    • Unified QSAR approach to antimicrobials. 4. Multi-target QSAR modeling and comparative multi-distance study of the giant components of antiviral drug-drug complex networks
    • Prado-Prado, F.J.; Martinez de la Vega, O.; Uriarte, E.; Ubeira, F.M.; Chou, K. C.; Gonzalez-Diaz, H. Unified QSAR approach to antimicrobials. 4. Multi-target QSAR modeling and comparative multi-distance study of the giant components of antiviral drug-drug complex networks. Bioorg. Med. Chem., 2009, 17(2), 569-575.
    • (2009) Bioorg. Med. Chem , vol.17 , Issue.2 , pp. 569-575
    • Prado-Prado, F.J.1    Uriarte, E.2    Ubeira, F.M.3    Chou, K.C.4    Gonzalez-Diaz, H.5
  • 31
    • 3242792729 scopus 로고    scopus 로고
    • Review: Structural bioinformatics and its impact to biomedical science
    • Chou, K. C. Review: Structural bioinformatics and its impact to biomedical science. Curr. Med. Chem., 2004, 11(16), 2105-2134.
    • (2004) Curr. Med. Chem , vol.11 , Issue.16 , pp. 2105-2134
    • Chou, K.C.1
  • 32
    • 33750554701 scopus 로고    scopus 로고
    • Review: Progress in computational approach to drug development against SARS
    • Chou, K. C.; Wei, D. Q.; Du, Q. S.; Sirois, S. & Zhong, W. Z. Review: Progress in computational approach to drug development against SARS. Curr. Med. Chem., 2006, 13(27), 3263-3270.
    • (2006) Curr. Med. Chem , vol.13 , Issue.27 , pp. 3263-3270
    • Chou, K.C.1    Wei, D.Q.2    Du, Q.S.3    Sirois, S.4    Zhong, W.Z.5
  • 33
    • 2642517838 scopus 로고    scopus 로고
    • Insights from Modelling the 3D structure of the extracellular domain of alpha-7 nicotinic acetylcholine receptor
    • Chou, K. C. Insights from Modelling the 3D structure of the extracellular domain of alpha-7 nicotinic acetylcholine receptor. Bio-chem. Biophys. Res. Commun., 2004, 319(2), 433-438.
    • (2004) Bio-chem. Biophys. Res. Commun , vol.319 , Issue.2 , pp. 433-438
    • Chou, K.C.1
  • 34
    • 7044241339 scopus 로고    scopus 로고
    • Insights from modeling the tertiary structure of human BACE2
    • Chou, K. C. Insights from modeling the tertiary structure of human BACE2. J. Proteome Res., 2004, 3(5), 1069-1072.
    • (2004) J. Proteome Res , vol.3 , Issue.5 , pp. 1069-1072
    • Chou, K.C.1
  • 35
    • 13244290092 scopus 로고    scopus 로고
    • Molecular modelling and chemical modification for finding peptide inhibitor against SARS CoV Mpro
    • Du, Q. S.; Wang, S.; Wei, D. Q.; Sirois, S.; Chou, K. C. Molecular modelling and chemical modification for finding peptide inhibitor against SARS CoV Mpro. Anal. Biochem., 2005, 337(2), 262-270.
    • (2005) Anal. Biochem , vol.337 , Issue.2 , pp. 262-270
    • Du, Q.S.1    Wang, S.2    Wei, D.Q.3    Sirois, S.4    Chou, K.C.5
  • 36
    • 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, R. B.; Du, Q. S.; Wang, C. H.; Chou, K. C. 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(4), 1243-1247.
    • (2008) Biochem. Biophys. Res. Commun , vol.377 , Issue.4 , pp. 1243-1247
    • Huang, R.B.1    Du, Q.S.2    Wang, C.H.3    Chou, K.C.4
  • 37
    • 38749106195 scopus 로고    scopus 로고
    • Structure and mechanism of the M2 proton channel of influenza A virus
    • Schnell, J. R.; Chou, J. J. Structure and mechanism of the M2 proton channel of influenza A virus. Nature, 2008, 451(7178), 591-595.
    • (2008) Nature , vol.451 , Issue.7178 , pp. 591-595
    • Schnell, J.R.1    Chou, J.J.2
  • 38
    • 2942750460 scopus 로고    scopus 로고
    • Virtual screening for SARS-CoV protease based on KZ7088 pharmacophore points
    • Wei, D. Q.; Du, Q. S.; Chou, K. C. Virtual screening for SARS-CoV protease based on KZ7088 pharmacophore points. J. Chem.Inf. Comput. Sci., 2004, 44(3), 1111-1122.
    • (2004) J. Chem.inf. Comput. Sci , vol.44 , Issue.3 , pp. 1111-1122
    • Wei, D.Q.1    Du, Q.S.2    Chou, K.C.3
  • 39
    • 0037011899 scopus 로고    scopus 로고
    • 7-Substituted 5-amino-2-(2-furyl)pyrazolo[4,3-e]-1,2,4-triazolo[1,5-c]pyrimidines as A2A adenosine receptor antagonists: A study on the importance of modifications at the side chain on the activity and solubility
    • Baraldi, P. G.; Cacciari, B.; Romagnoli, R.; Spalluto, G.; Monopoli, A.; Ongini, E.; Varani, K.; Borea, P. A. 7-Substituted 5-amino-2-(2-furyl)pyrazolo[4,3-e]-1,2,4-triazolo[1,5-c]pyrimidines as A2A adenosine receptor antagonists: A study on the importance of modifications at the side chain on the activity and solubility. J. Med. Chem., 2002, 45(1), 115-126.
    • (2002) J. Med. Chem , vol.45 , Issue.1 , pp. 115-126
    • Baraldi, P.G.1    Cacciari, B.2    Romagnoli, R.3    Spalluto, G.4    Monopoli, A.5    Ongini, E.6    Varani, K.7    Borea, P.A.8
  • 41
    • 0033532596 scopus 로고    scopus 로고
    • A model of the complex between cyclin-dependent kinase 5 and the activation domain of neuronal Cdk5 activator
    • Chou, K. C.; Watenpaugh, K. D.; Heinrikson, R. L. A model of the complex between cyclin-dependent kinase 5 and the activation domain of neuronal Cdk5 activator. Biochem. Biophys. Res. Commun., 1999, 259(2), 420-428.
    • (1999) Biochem. Biophys. Res. Commun , vol.259 , Issue.2 , pp. 420-428
    • Chou, K.C.1    Watenpaugh, K.D.2    Heinrikson, R.L.3
  • 42
    • 26844549522 scopus 로고    scopus 로고
    • Application of bioinformatics in search for cleavable peptides of SARS-CoV Mpro and chemical modification of octapeptides
    • Du, Q. S.; Wang, S. Q.; Jiang, Z. Q.; Gao, W. N.; Li, Y. D.; Wei, D. Q.; Chou, K. C. Application of bioinformatics in search for cleavable peptides of SARS-CoV Mpro and chemical modification of octapeptides. Med. Chem., 2005b, 1(3), 209-213
    • (2005) Med. Chem , vol.1 , Issue.3 , pp. 209-213
    • Du, Q.S.1    Wang, S.Q.2    Jiang, Z.Q.3    Gao, W.N.4    Li, Y.D.5    Wei, D.Q.6    Chou, K.C.7
  • 43
    • 47349097287 scopus 로고    scopus 로고
    • Computational studies of the binding modes of A2A adenosine receptor antagonists
    • Ye, Y.; Wei, J.; Dai, X.; Gao, Q. Computational studies of the binding modes of A2A adenosine receptor antagonists. Amino Ac- ids, 2008, 35(2), 389-396.
    • (2008) Amino Ac- Ids , vol.35 , Issue.2 , pp. 389-396
    • Ye, Y.1    Wei, J.2    Dai, X.3    Gao, Q.4
  • 44
    • 34248679618 scopus 로고    scopus 로고
    • Agaritine and its derivatives are potential inhibitors against HIV proteases
    • Gao, W. N.; Wei, D. Q.; Li, Y.; Gao, H.; Xu, W. R.; Li, A. X.; Chou, K. C. Agaritine and its derivatives are potential inhibitors against HIV proteases. Med. Chem., 2007, 3(3), 221-226.
    • (2007) Med. Chem , vol.3 , Issue.3 , pp. 221-226
    • Gao, W.N.1    Wei, D.Q.2    Li, Y.3    Gao, H.4    Xu, W.R.5    Li, A.X.6    Chou, K.C.7
  • 45
    • 34249743013 scopus 로고    scopus 로고
    • Computational studies of the binding mechanism of calmodulin with chrysin
    • Li, L.; Wei, D. Q.; Wang, J. F.; Chou, K. C. Computational studies of the binding mechanism of calmodulin with chrysin. Biochem. Biophys. Res. Commun., 2007, 358(4), 1102-1107.
    • (2007) Biochem. Biophys. Res. Commun , vol.358 , Issue.4 , pp. 1102-1107
    • Li, L.1    Wei, D.Q.2    Wang, J.F.3    Chou, K.C.4
  • 46
    • 0031449933 scopus 로고    scopus 로고
    • Prediction of the tertiary structure and substrate binding site of caspase-8
    • Chou, K. C.; Jones, D.; Heinrikson, R.L. Prediction of the tertiary structure and substrate binding site of caspase-8. FEBS Lett., 1997, 419(1), 49-54.
    • (1997) Febs Lett , vol.419 , Issue.1 , pp. 49-54
    • Chou, K.C.1    Jones, D.2    Heinrikson, R.L.3
  • 47
    • 0034737556 scopus 로고    scopus 로고
    • Prediction of the tertiary structure of a caspase-9/inhibitor complex
    • Chou, K. C.; Tomasselli, A. G.; Heinrikson, R. L. Prediction of the tertiary structure of a caspase-9/inhibitor complex. FEBS Lett., 2000, 470(3), 249-256.
    • (2000) Febs Lett , vol.470 , Issue.3 , pp. 249-256
    • Chou, K.C.1    Tomasselli, A.G.2    Heinrikson, R.L.3
  • 48
    • 0041848237 scopus 로고    scopus 로고
    • Binding mechanism of coronavirus main proteinase with ligands and its implication to drug design against SARS
    • Chou, K. C.; Wei, D. Q.; Zhong, W. Z. Binding mechanism of coronavirus main proteinase with ligands and its implication to drug design against SARS. Biochem. Biophys. Res. Commun., 2003, 308(1), 148-151.
    • (2003) Biochem. Biophys. Res. Commun , vol.308 , Issue.1 , pp. 148-151
    • Chou, K.C.1    Wei, D.Q.2    Zhong, W.Z.3
  • 49
    • 11144275172 scopus 로고    scopus 로고
    • Molecular therapeutic target for type-2 diabetes
    • Chou, K. C. Molecular therapeutic target for type-2 diabetes. J. Proteome Res., 2004, 3(4), 1284-1288.
    • (2004) J. Proteome Res , vol.3 , Issue.4 , pp. 1284-1288
    • Chou, K.C.1
  • 50
    • 0029043501 scopus 로고
    • Site-directed mutagenesis identifies residues involved in ligand recognition in the human A2A adenosine receptor
    • Kim, J.; Wess, J.; Van, R. A.M.; Schoneberg, T.; Jacobson, K. A. Site-directed mutagenesis identifies residues involved in ligand recognition in the human A2A adenosine receptor. J. Biol. Chem., 1995, 270(23), 13987-13997.
    • (1995) J. Biol. Chem , vol.270 , Issue.23 , pp. 13987-13997
    • Kim, J.1    Wess, J.2    Van, R.A.M.3    Schoneberg, T.4    Jacobson, K.A.5
  • 51
    • 0038819890 scopus 로고    scopus 로고
    • Medicinal chemistry of A2A adenosine receptor antagonists
    • Barbara, C.; Giorgia, P.; Giampiero, S. Medicinal chemistry of A2A adenosine receptor antagonists. Curr. Top. Med. Chem., 2003, 3(4), 403-411.
    • (2003) Curr. Top. Med. Chem , vol.3 , Issue.4 , pp. 403-411
    • Barbara, C.1    Giorgia, P.2    Giampiero, S.3
  • 52
    • 84986522856 scopus 로고
    • Poling: Promoting conforma- tional variation
    • Smellie, A.; Teig, S. L.; Towbin, P. Poling: Promoting conforma- tional variation. J. Comput. Chem., 1995, 16(2), 171-187.
    • (1995) J. Comput. Chem , vol.16 , Issue.2 , pp. 171-187
    • Smellie, A.1    Teig, S.L.2    Towbin, P.3
  • 53
    • 77950012311 scopus 로고    scopus 로고
    • Catalyst, version 4.10; Accelrys Inc.: San Diego, USA
    • Catalyst, version 4.10; Accelrys Inc.: San Diego, USA, 2005.
    • (2005)
  • 54
    • 77949970374 scopus 로고    scopus 로고
    • Catalyst 4.10 Tutorials
    • Catalyst 4.10 Tutorials: http://www.accelrys.com/doc/pdf/index.html
  • 55
    • 35348888406 scopus 로고    scopus 로고
    • Predicting the affinity of epitope-peptides with class I MHC mole- cule HLA-A*0201: An application of amino acid-based peptide prediction
    • Du, Q. S.; Wei, Y. T.; Pang, Z. W.; Chou, K. C.; Huang, R. B. Predicting the affinity of epitope-peptides with class I MHC molecule HLA-A*0201: an application of amino acid-based peptide prediction. Protein Eng. Des. Sel., 2007, 20(9), 417-423.
    • (2007) Protein Eng. Des. Sel , vol.20 , Issue.9 , pp. 417-423
    • Du, Q.S.1    Wei, Y.T.2    Pang, Z.W.3    Chou, K.C.4    Huang, R.B.5


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.