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Volume 47; Issue 1

Journal of Medicinal Chemistry

Volume 47; Issue 1

1

Multiple Active Site Corrections for Docking and Virtual Screening

Vigers, Guy P. A., Rizzi, James P.

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 458 KB

english, 2004

2

Chemical Basis for the Biological Activity of Imexon and Related Cyanoaziridines

Iyengar, Bhashyam S., Dorr, Robert T., Remers, William A.

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 148 KB

english, 2004

3

Synthesis and Structure−Activity Relationships of 5,6,7,8-Tetrahydro-4H-thieno[3,2-b]azepine Derivatives: Novel Arginine Vasopressin Antagonists

Cho, Hidetsura, Murakami, Kengo, Nakanishi, Hiroyuki, Fujisawa, Akitaka, Isoshima, Hirotaka, Niwa, Misako, Hayakawa, Kazuhide, Hase, Yasunori, Uchida, Itsuo, Watanabe, Hidenori

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 197 KB

english, 2004

4

Potent Inhibitors of the Plasmodium falciparum Enzymes Plasmepsin I and II Devoid of Cathepsin D Inhibitory Activity

Ersmark, Karolina, Feierberg, Isabella, Bjelic, Sinisa, Hamelink, Elizabeth, Hackett, Fiona, Blackman, Michael J., Hultén, Johan, Samuelsson, Bertil, Åqvist, Johan, Hallberg, Anders

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 401 KB

english, 2004

5

Synthesis, in Vitro Evaluation, and Antileishmanial Activity of Water-Soluble Prodrugs of Buparvaquone

Mäntylä, Antti, Garnier, Tracy, Rautio, Jarkko, Nevalainen, Tapio, Vepsälainen, Jouko, Koskinen, Ari, Croft, Simon L., Järvinen, Tomi

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 83 KB

english, 2004

6

Cyclodextrin-Derived Diorganyl Tellurides as Glutathione Peroxidase Mimics and Inhibitors of Thioredoxin Reductase and Cancer Cell Growth

McNaughton, Michael, Engman, Lars, Birmingham, Anne, Powis, Garth, Cotgreave, Ian A.

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 198 KB

english, 2004

7

Lessons in Molecular Recognition: The Effects of Ligand and Protein Flexibility on Molecular Docking Accuracy

Erickson, Jon A., Jalaie, Mehran, Robertson, Daniel H., Lewis, Richard A., Vieth, Michal

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 181 KB

english, 2004

8

10-Ketomorphinan and 3-Substituted-3-desoxymorphinan Analogues as Mixed κ and μ Opioid Ligands: Synthesis and Biological Evaluation of Their Binding Affinity at Opioid Receptors

Zhang, Ao, Xiong, Wennan, Bidlack, Jean M., Hilbert, James E., Knapp, Brian I., Wentland, Mark P., Neumeyer, John L.

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 206 KB

english, 2004

9

Effects of Bisphosphonates on the Growth of Entamoeba histolytica and Plasmodium Species in Vitro and in Vivo

Ghosh, Subhash, Chan, Julian M. W., Lea, Christopher R., Meints, Gary A., Lewis, Jared C., Tovian, Zev S., Flessner, Ryan M., Loftus, Timothy C., Bruchhaus, Iris, Kendrick, Howard, Croft, Simon L., Ke

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 416 KB

english, 2004

10

Synthesis and Biological Evaluation of Analogues of 7-Chloro-4,5-dihydro-4- oxo-8-(1,2,4-triazol-4-yl)-1,2,4-triazolo[1,5- a ]quinoxaline-2-carboxylic Acid (TQX-173) as Novel Selective AMPA Receptor Antagonists

Catarzi, Daniela, Colotta, Vittoria, Varano, Flavia, Calabri, Francesca Romana, Filacchioni, Guido, Galli, Alessandro, Costagli, Chiara, Carlà, Vincenzo

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 177 KB

english, 2004

11

Folate-Synthesizing Enzyme System as Target for Development of Inhibitors and Inhibitor Combinations against Candida a lbicans Synthesis and Biological Activity of New 2,4-Diaminopyrimidines and 4‘-Substituted 4-Aminodiphenyl Sulfones

Otzen, Thomas, Wempe, Ellen G., Kunz, Brigitte, Bartels, Rainer, Lehwark-Yvetot, Gudrun, Hänsel, Wolfram, Schaper, Klaus-Jürgen, Seydel, Joachim K.

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 202 KB

english, 2004

12

Benzoxazinones as PPARγ Agonists. 2. SAR of the Amide Substituent and In Vivo Results in a Type 2 Diabetes Model

Rybczynski, Philip J., Zeck, Roxanne E., Dudash, Joseph, Combs, Donald W., Burris, Thomas P., Yang, Maria, Osborne, Melville C., Chen, Xiaoli, Demarest, Keith T.

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 238 KB

english, 2004

13

Discovery of Small-Molecule Inhibitors of the ATPase Activity of Human Papillomavirus E1 Helicase

Faucher, Anne-Marie, White, Peter W., Brochu, Christian, Grand-Maître, Chantal, Rancourt, Jean, Fazal, Gulrez

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 88 KB

english, 2004

14

Syntheses, Calcium Channel Agonist−Antagonist Modulation Activities, and Nitric Oxide Release Studies of Nitrooxyalkyl 1,4-Dihydro-2,6-dimethyl-3-nitro-4-(2,1,3-benzoxadiazol-4-yl)pyridine-5-carboxylate Racemates, Enantiomers, and Diastereomers

Shan, Rudong, Velazquez, Carlos, Knaus, Edward E.

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 213 KB

english, 2004

15

Characteristic Physical Properties and Structural Fragments of Marketed Oral Drugs

Vieth, Michal, Siegel, Miles G., Higgs, Richard E., Watson, Ian A., Robertson, Daniel H., Savin, Kenneth A., Durst, Gregory L., Hipskind, Philip A.

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 153 KB

english, 2004

16

Antimycobacterial Agents. 1. Thio Analogues of Purine †

Pathak, Ashish K., Pathak, Vibha, Seitz, Lainne E., Suling, William J., Reynolds, Robert C.

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 56 KB

english, 2004

17

Discovery of α,γ-Diketo Acids as Potent Selective and Reversible Inhibitors of Hepatitis C Virus NS5b RNA-Dependent RNA Polymerase

Summa, Vincenzo, Petrocchi, Alessia, Pace, Paola, Matassa, Victor G., De Francesco, Raffaele, Altamura, Sergio, Tomei, Licia, Koch, Uwe, Neuner, Philippe

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 55 KB

english, 2004

18

The Discovery of Ezetimibe: A View from Outside the Receptor

Clader, John W.

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 260 KB

english, 2004

19

Design and Synthesis of Hydroxyethylene-Based Peptidomimetic Inhibitors of Human β-Secretase

Hom, Roy K., Gailunas, Andrea F., Mamo, Shumeye, Fang, Larry Y., Tung, Jay S., Walker, Donald E., Davis, David, Thorsett, Eugene D., Jewett, Nancy E., Moon, Joseph B., John, Varghese

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 201 KB

english, 2004

20

Evaluation and Comparison of 3D-QSAR CoMSIA Models for CDK1, CDK5, and GSK-3 Inhibition by Paullones

Kunick, Conrad, Lauenroth, Kathrin, Wieking, Karen, Xie, Xu, Schultz, Christiane, Gussio, Rick, Zaharevitz, Daniel, Leost, Maryse, Meijer, Laurent, Weber, Alexander, Jørgensen, Flemming S., Lemcke, Th

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 463 KB

english, 2004

21

HierVLS Hierarchical Docking Protocol for Virtual Ligand Screening of Large-Molecule Databases

Floriano, Wely B., Vaidehi, Nagarajan, Zamanakos, Georgios, Goddard, William A.

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 326 KB

english, 2004

22

Pyrrolo[1,3]benzothiazepine-Based Serotonin and Dopamine Receptor Antagonists. Molecular Modeling, Further Structure−Activity Relationship Studies, and Identification of Novel Atypical Antipsychotic Agents

Campiani, Giuseppe, Butini, Stefania, Fattorusso, Caterina, Catalanotti, Bruno, Gemma, Sandra, Nacci, Vito, Morelli, Elena, Cagnotto, Alfredo, Mereghetti, Ilario, Mennini, Tiziana, Carli, Miriana, Min

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 433 KB

english, 2004

23

Self-Association of Okadaic Acid upon Complexation with Potassium Ion

Daranas, Antonio H., Fernández, José J., Morales, Ezequiel Q., Norte, Manuel, Gavín, José A.

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 142 KB

english, 2004

24

Design, Synthesis, Molecular Modeling Studies, and Calpain Inhibitory Activity of Novel α-Ketoamides Incorporating Polar Residues at the P 1 ‘-Position

Donkor, Isaac O., Han, Jie, Zheng, Xiaozhang

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 269 KB

english, 2004

25

Molecular Recognition of Sub-micromolar Inhibitors by the Epinephrine-Synthesizing Enzyme Phenylethanolamine N- Methyltransferase

McMillan, Fiona M., Archbold, Julia, McLeish, Michael J., Caine, Joanne M., Criscione, Kevin R., Grunewald, Gary L., Martin, Jennifer L.

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 322 KB

english, 2004

26

NMR Structural Characterization of Peptide Inhibitors Bound to the Hepatitis C Virus NS3 Protease: Design of a New P2 Substituent

Goudreau, Nathalie, Cameron, Dale R., Bonneau, Pierre, Gorys, Vida, Plouffe, Céline, Poirier, Martin, Lamarre, Daniel, Llinas-Brunet, Montse

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 316 KB

english, 2004

27

Effects of pH on the Cytotoxicity of Sodium Trioxodinitrate (Angeli's Salt)

Stoyanovsky, Detcho A., Schor, Nina F., Nylander, Karen D., Salama, Guy

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 126 KB

english, 2004

28

Highly Diverse Heparan Sulfate Analogue Libraries: Providing Access to Expanded Areas of Sequence Space for Bioactivity Screening

Yates, Edwin A., Guimond, Scott E., Turnbull, Jeremy E.

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 67 KB

english, 2004

29

Three-Dimensional Quantitative Structure−Activity Relationship Modeling of Cocaine Binding by a Novel Human Monoclonal Antibody

Paula, Stefan, Tabet, Michael R., Farr, Carol D., Norman, Andrew B., Ball, W. James

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 420 KB

english, 2004

30

Pyrrolobenzimidazoles Linked to Heterocycles and Peptides. Design of DNA Base Pair Specific Phosphate Hydrolyzing Agents and Novel Cytotoxic Agents

Ghodousi, Arman, Huang, Xiaofen, Cheng, Zheng, Skibo, Edward B.

Journal:

Journal of Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 546 KB

english, 2004