Table of Contents
December 16, 2004
Volume 47, Issue 26
Pages 6435-6654
About the Cover: Ribbon rendered illustration of the nuclear receptor heterodimer RXRα(cyan):PPARRγ (red) ligand binding domains bound with coactivator peptides (magenta) and agonist ligands (space-filling atoms where green is carbon, red is oxygen, and blue is nitrogen) (Haffner, C. D.; et al. J. Med. Chem. 2004, 47, 2010-2029).
Letters
Synthesis and Activity of Substituted 4-(Indazol-3-yl)phenols as Pathway-Selective Estrogen Receptor Ligands Useful in the Treatment of Rheumatoid Arthritis
Robert J. Steffan, Edward Matelan, Mark A. Ashwell, William J. Moore, William R. Solvibile, Eugene Trybulski, Christopher C. Chadwick, Susan Chippari, Thomas Kenney, Amy Eckert, Lisa Borges-Marcucci, James C. Keith, Zhang Xu, Lydia Mosyak, and Douglas C. Harnish
pp 6435–6438Publication Date (Web): November 12, 2004 (Letter)
DOI: 10.1021/jm049194+
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Hi-Res PDF2,3-Diaminopyridine Bradykinin B1 Receptor Antagonists
Scott D. Kuduk, Christina Ng, Dong-Mei Feng, Jenny M.-C. Wai, Raymond S. L. Chang, Charles M. Harrell, Kathy L. Murphy, Richard W. Ransom, Duane Reiss, Magnus Ivarsson, Glenn Mason, Susan Boyce, Cuyue Tang, Thomayant Prueksaritanont, Roger M. Freidinger, Douglas J. Pettibone, and Mark G. Bock
pp 6439–6442Publication Date (Web): November 13, 2004 (Letter)
DOI: 10.1021/jm049394l
The Design and Enzyme-Bound Crystal Structure of Indoline Based Peptidomimetic Inhibitors of Hepatitis C Virus NS3 Protease
Jesus M. Ontoria, Stefania Di Marco, Immacolata Conte, M. Emilia Di Francesco, Cristina Gardelli, Uwe Koch, Victor G. Matassa, Marco Poma, Christian Steinkühler, Cinzia Volpari, and Steven Harper
pp 6443–6446Publication Date (Web): November 13, 2004 (Letter)
DOI: 10.1021/jm049435d
Structure-Based Design of Potent and Selective Cell-Permeable Inhibitors of Human β-Secretase (BACE-1)
Shawn J. Stachel, Craig A. Coburn, Thomas G. Steele, Kristen G. Jones, Elizabeth F. Loutzenhiser, Alison R. Gregro, Hemaka A. Rajapakse, Ming-Tain Lai, Ming-Chih Crouthamel, Min Xu, Katherine Tugusheva, Janet E. Lineberger, Beth L. Pietrak, Amy S. Espeseth, Xiao-Ping Shi, Elizabeth Chen-Dodson, M. Katharine Holloway, Sanjeev Munshi, Adam J. Simon, Lawrence Kuo, and Joseph P. Vacca
pp 6447–6450Publication Date (Web): November 11, 2004 (Letter)
DOI: 10.1021/jm049379g
Novel 2-(Substituted phenyl)benzimidazole Derivatives with Potent Activity against IgE, Cytokines, and CD23 for the Treatment of Allergy and Asthma
Mark L. Richards, Shirley Cruz Lio, Anjana Sinha, Kenneth K. Tieu, and Jagadish C. Sircar
pp 6451–6454Publication Date (Web): November 13, 2004 (Letter)
DOI: 10.1021/jm049288j
Design and Synthesis of a Potent and Selective Peptidomimetic Inhibitor of Caspase-3
Nicola Micale, Rajendran Vairagoundar, Alexander G. Yakovlev, and Alan P. Kozikowski
pp 6455–6458Publication Date (Web): November 18, 2004 (Letter)
DOI: 10.1021/jm049248f
Articles
Synthesis and Anti-Tubulin Activity of a 3‘-(4-Azidophenyl)-3‘-dephenylpaclitaxel Photoaffinity Probe
Jared T. Spletstoser, Patrick T. Flaherty, Richard H. Himes, and Gunda I. Georg
pp 6459–6465Publication Date (Web): November 11, 2004 (Article)
DOI: 10.1021/jm030581d
Catecholic Flavonoids Acting as Telomerase Inhibitors
Maria Menichincheri, Dario Ballinari, Alberto Bargiotti, Luisella Bonomini, Walter Ceccarelli, Roberto D'Alessio, Antonella Fretta, Juergen Moll, Paolo Polucci, Chiara Soncini, Marcellino Tibolla, Jean-Yves Trosset, and Ermes Vanotti
pp 6466–6475Publication Date (Web): November 12, 2004 (Article)
DOI: 10.1021/jm040810b
Calcitriol Derivatives with Two Different Side Chains at C-20. II. Diastereoselective Syntheses of the Metabolically Produced 24(R)-Hydroxygemini1
Hubert Maehr, Milan R. Uskokovic, Luciano Adorini, and G. Satyanarayana Reddy
pp 6476–6484Publication Date (Web): November 20, 2004 (Article)
DOI: 10.1021/jm049340b
Stereochemical Analysis of (Hydroxyethyl)urea Peptidomimetic Inhibitors of γ-Secretase
Pancham Bakshi and Michael S. Wolfe
pp 6485–6489Publication Date (Web): November 16, 2004 (Article)
DOI: 10.1021/jm049566e
Structure−Activity Relationships of Acetylcholinesterase Noncovalent Inhibitors Based on a Polyamine Backbone. 3. Effect of Replacing the Inner Polymethylene Chain with Cyclic Moieties
Vincenzo Tumiatti, Vincenza Andrisano, Rita Banzi, Manuela Bartolini, Anna Minarini, Michela Rosini, and Carlo Melchiorre
pp 6490–6498Publication Date (Web): November 16, 2004 (Article)
DOI: 10.1021/jm0494366
Inhibition of Streptococcus suis Adhesion by Dendritic Galabiose Compounds at Low Nanomolar Concentration
John A. F. Joosten, Vuokko Loimaranta, Chantal C. M. Appeldoorn, Sauli Haataja, Fatna Ait El Maate, Rob M. J. Liskamp, Jukka Finne, and Roland J. Pieters
pp 6499–6508Publication Date (Web): November 11, 2004 (Article)
DOI: 10.1021/jm049476+
Antiestrogen Binding Site and Estrogen Receptor Mediate Uptake and Distribution of 4-Hydroxytamoxifen-Targeted Doxorubicin−Formaldehyde Conjugate in Breast Cancer Cells
Patrick J. Burke, Brian T. Kalet, and Tad H. Koch
pp 6509–6518Publication Date (Web): November 18, 2004 (Article)
DOI: 10.1021/jm049496b
Synthesis and Structure−Activity Relationship Studies for Hydantoins and Analogues as Voltage-Gated Sodium Channel Ligands
Congxiang Zha, George B. Brown, and Wayne J. Brouillette
pp 6519–6528Publication Date (Web): November 18, 2004 (Article)
DOI: 10.1021/jm040077o
2,4,6-Trisubstituted Pyrimidines as a New Class of Selective Adenosine A1 Receptor Antagonists
Lisa C. W. Chang, Ronald F. Spanjersberg, Jacobien K. von Frijtag Drabbe Künzel, Thea Mulder-Krieger, Gijs van den Hout, Margot W. Beukers, Johannes Brussee, and Adriaan P. IJzerman
pp 6529–6540Publication Date (Web): November 13, 2004 (Article)
DOI: 10.1021/jm049448r
Highly Selective Fluorescent Analogue of the Potent δ-Opioid Receptor Antagonist Dmt-Tic
Gianfranco Balboni, Severo Salvadori, Alessandro Dal Piaz, Fabrizio Bortolotti, Roberto Argazzi, Lucia Negri, Roberta Lattanzi, Sharon D. Bryant, Yunden Jinsmaa, and Lawrence H. Lazarus
pp 6541–6546Publication Date (Web): November 20, 2004 (Article)
DOI: 10.1021/jm040128h
Molecular Interaction Model for the C1B Domain of Protein Kinase C-γ in the Complex with Its Activator Phorbol-12-myristate-13-acetate in Water Solution and Lipid Bilayer
Jozef Hritz, Jozef Ulicny, Aatto Laaksonen, Daniel Jancura, and Pavol Miskovsky
pp 6547–6555Publication Date (Web): November 13, 2004 (Article)
DOI: 10.1021/jm049786s
Structure−Activity Relationship of 6-Methylidene Penems Bearing Tricyclic Heterocycles as Broad-Spectrum β-Lactamase Inhibitors: Crystallographic Structures Show Unexpected Binding of 1,4-Thiazepine Intermediates
Aranapakam M. Venkatesan, Yansong Gu, Osvaldo Dos Santos, Takao Abe, Atul Agarwal, Youjun Yang, Peter J. Petersen, William J. Weiss, Tarek S. Mansour, Michiyoshi Nukaga, Andrea M. Hujer, Robert A. Bonomo, and James R. Knox
pp 6556–6568Publication Date (Web): November 18, 2004 (Article)
DOI: 10.1021/jm049680x
Molecular Surface Point Environments for Virtual Screening and the Elucidation of Binding Patterns (MOLPRINT 3D)
Andreas Bender, Hamse Y. Mussa, Gurprem S. Gill, and Robert C. Glen
pp 6569–6583Publication Date (Web): November 16, 2004 (Article)
DOI: 10.1021/jm049611i
A Systematic Approach to the Optimization of Substrate-Based Inhibitors of the Hepatitis C Virus NS3 Protease: Discovery of Potent and Specific Tripeptide Inhibitors
Montse Llinàs-Brunet, Murray D. Bailey, Elise Ghiro, Vida Gorys, Ted Halmos, Martin Poirier, Jean Rancourt, and Nathalie Goudreau
pp 6584–6594Publication Date (Web): November 20, 2004 (Article)
DOI: 10.1021/jm0494523
Design, Synthesis and Evaluation of a PLG Tripeptidomimetic Based on a Pyridine Scaffold
Stina Saitton, Andria L. Del Tredici, Nina Mohell, Roeland C. Vollinga, Dan Boström, Jan Kihlberg, and Kristina Luthman
pp 6595–6602Publication Date (Web): November 18, 2004 (Article)
DOI: 10.1021/jm049484q
Discovery of Pyrano[3,4-b]indoles as Potent and Selective HCV NS5B Polymerase Inhibitors
Ariamala Gopalsamy, Kitae Lim, Gregory Ciszewski, Kaapjoo Park, John W. Ellingboe, Jonathan Bloom, Shabana Insaf, Janis Upeslacis, Tarek S. Mansour, Girija Krishnamurthy, Murthy Damarla, Yelena Pyatski, Douglas Ho, Anita Y. M. Howe, Mark Orlowski, Boris Feld, and John O'Connell
pp 6603–6608Publication Date (Web): November 19, 2004 (Article)
DOI: 10.1021/jm0401255
Identification of Novel Parasitic Cysteine Protease Inhibitors Using Virtual Screening. 1. The ChemBridge Database
Prashant V. Desai, Akshay Patny, Yogesh Sabnis, Babu Tekwani, Jiri Gut, Philip Rosenthal, Anuradha Srivastava, and Mitchell Avery
pp 6609–6615Publication Date (Web): November 19, 2004 (Article)
DOI: 10.1021/jm0493717
Structure−Affinity Relationship Study on N-(1,2,3,4-Tetrahydronaphthalen-1-yl)-4-Aryl-1-Piperazinealkylamides, a New Class of 5-Hydroxytryptamine7 Receptor Agents
Marcello Leopoldo, Francesco Berardi, Nicola A. Colabufo, Marialessandra Contino, Enza Lacivita, Mauro Niso, Roberto Perrone, and Vincenzo Tortorella
pp 6616–6624Publication Date (Web): November 19, 2004 (Article)
DOI: 10.1021/jm049702f
Comparative in Vivo Behavior Studies of Cyclen-Based Copper-64 Complexes: Regioselective Synthesis, X-ray Structure, Radiochemistry, log P, and Biodistribution
Jeongsoo Yoo, David E. Reichert, and Michael J. Welch
pp 6625–6637Publication Date (Web): November 20, 2004 (Article)
DOI: 10.1021/jm0496990
Synthetic Bryostatin Analogues Activate the RasGRP1 Signaling Pathway
James C. Stone, Stacey L. Stang, Yong Zheng, Nancy A. Dower, Stacey E. Brenner, Jeremy L. Baryza, and Paul A. Wender
pp 6638–6644Publication Date (Web): November 19, 2004 (Article)
DOI: 10.1021/jm0495069
Brief Articles
Effects of Substitution on the Pyrrole N Atom in Derivatives of Tetrahydronaltrindole, Tetrahydrooxymorphindole, and a Related 4,5-Epoxyphenylpyrrolomorphinan
Sanjay K. Srivastava, Shefali, Carl N. Miller, Mario D. Aceto, John R. Traynor, John W. Lewis, and Stephen M. Husbands
pp 6645–6648Publication Date (Web): November 16, 2004 (Brief Article)
DOI: 10.1021/jm040817t
Synthesis and Antibacterial Activity of New Poly-S-lysine−Porphyrin Conjugates
João P. C. Tomé, Maria G. P. M. S. Neves, Augusto C. Tomé, José A. S. Cavaleiro, Marina Soncin, Michela Magaraggia, Stefania Ferro, and Giulio Jori
pp 6649–6652Publication Date (Web): November 18, 2004 (Brief Article)
DOI: 10.1021/jm040802v
Book Reviews
Annual Review of Pharmacology and Toxicology. Volume 44 Edited by Arthur K. Cho, Terrence F. Blaschke, Paul A. Insel, and Horace H. Loh. Annual Reviews, Palo Alto, CA. 2004. viii + 647 pp. 15.5 × 23.5 cm. ISBN 0-8243-04.44-6. $74.00.
Bruce L. Currie
p 6653Publication Date (Web): November 05, 2004 (Book Review)
DOI: 10.1021/jm040173p
Chemoinformatics, Concepts, Methods, and Tools for Drug Discovery Edited by Jurgen Bajorath. Humana Press Inc., Totowa, NJ. 2004. xiii + 524 pp. 15.5 × 23.5 cm. ISBN 1-588-29-261-4. $125.00.
Jan W. F. Wasley
p 6653Publication Date (Web): October 28, 2004 (Book Review)
DOI: 10.1021/jm040174h
Molecular Biology in Medicinal Chemistry Edited by Th. Dingermann, D. Steinhilber, and G. Folkers. Wiley-VCH, Weinheim, Germany. 2004. xxi + 413 pp. 17.5 × 24.5 cm. ISBN 3527304312. $195.00.
Kevin G. Rice
pp 6653–6654Publication Date (Web): November 02, 2004 (Book Review)
DOI: 10.1021/jm0401762
Protein Crystallograpy in Drug Discovery Edited by Robert E. Babine and Sherin S. Abdel-Meguid. Wiley-VCH Velag GmbH & Co., Weinheim, Germany. 2004. xvi +262 pp. 17 × 25 cm. ISBN 3527306781. $175.00.
Steven W. Muchmore
p 6654Publication Date (Web): November 12, 2004 (Book Review)
DOI: 10.1021/jm040169d