(4,4-Difluoropiperidin-yl)acetonitrile - PMC

Natalie Hawryluk, Dale Robinson, Yixing Shen, Graham Kyne, Matthew Bedore, Sanjay Menon, Stacie Canan, Thomas von Geldern, Simon Townson, Suzanne Gokool, Alexandra Ehrens, Marianne Koschel, Nathaly Lhermitte-Vallarino, Coralie Martin, Achim Hoerauf, Geraldine Hernandez, Deepak Dalvie, Sabine Specht, Marc Peter Hübner, Ivan Scandale

J Med Chem. 2022 Aug 25; 65(16): 11388–11403. Published online 2022 Aug 16. doi: 10.1021/acs.jmedchem.2c00960

PMCID:: PMC9421654

Abstract Article PDF–2.9M

Select item 71845634.

Achieving In Vivo Target Depletion through the Discovery and Optimization of Benzimidazolone BCL6 Degraders

Benjamin R. Bellenie, Kwai-Ming J. Cheung, Ana Varela, Olivier A. Pierrat, Gavin W. Collie, Gary M. Box, Michael D. Bright, Sharon Gowan, Angela Hayes, Matthew J. Rodrigues, Kartika N. Shetty, Michael Carter, Owen A. Davis, Alan T. Henley, Paolo Innocenti, Louise D. Johnson, Manjuan Liu, Selby de Klerk, Yann-Vaï Le Bihan, Matthew G. Lloyd, P. Craig McAndrew, Erald Shehu, Rachel Talbot, Hannah L. Woodward, Rosemary Burke, Vladimir Kirkin, Rob L. M. van Montfort, Florence I. Raynaud, Olivia W. Rossanese, Swen Hoelder

J Med Chem. 2020 Apr 23; 63(8): 4047–4068. Published online 2020 Apr 10. doi: 10.1021/acs.jmedchem.9b02076

PMCID:: PMC7184563

Abstract Article PDF–9.8M

Select item 99425285.

Design, Synthesis, Biological Evaluation, and Computational Studies of Novel Ureidopropanamides as Formyl Peptide Receptor 2 (FPR2) Agonists to Target the Resolution of Inflammation in Central Nervous System Disorders

Margherita Mastromarino, Maria Favia, Igor A. Schepetkin, Lylia N. Kirpotina, Ewa Trojan, Mauro Niso, Antonio Carrieri, Monika Leśkiewicz, Magdalena Regulska, Massimiliano Darida, Francesco Rossignolo, Stefano Fontana, Mark T. Quinn, Agnieszka Basta-Kaim, Marcello Leopoldo, Enza Lacivita

J Med Chem. Author manuscript; available in PMC 2023 Mar 24.

Published in final edited form as: J Med Chem. 2022 Mar 24; 65(6): 5004–5028. Published online 2022 Mar 8. doi: 10.1021/acs.jmedchem.1c02203

PMCID:: PMC9942528

Abstract Article PDF–2.7M

Select item 103509206.

Development of a 2,4-Diaminothiazole Series for the Treatment of Human African Trypanosomiasis Highlights the Importance of Static–Cidal Screening of Analogues

Laura A. T. Cleghorn, Richard J. Wall, Sébastien Albrecht, Stuart A. MacGowan, Suzanne Norval, Manu De Rycker, Andrew Woodland, Daniel Spinks, Stephen Thompson, Stephen Patterson, Victoriano Corpas Lopez, Gourav Dey, Iain T. Collie, Irene Hallyburton, Robert Kime, Frederick R. C. Simeons, Laste Stojanovski, Julie A. Frearson, Paul G. Wyatt, Kevin D. Read, Ian H. Gilbert, Susan Wyllie

J Med Chem. 2023 Jul 13; 66(13): 8896–8916. Published online 2023 Jun 21. doi: 10.1021/acs.jmedchem.3c00509

PMCID:: PMC10350920

Abstract Article PDF–5.1M

Select item 91650187.

Multiparameter Optimization of Oxidative Phosphorylation Inhibitors for the Treatment of Pancreatic Cancer

Ding Xue, Yibin Xu, Armita Kyani, Joyeeta Roy, Lipeng Dai, Duxin Sun, Nouri Neamati

J Med Chem. Author manuscript; available in PMC 2022 Jun 3.

Published in final edited form as: J Med Chem. 2022 Feb 24; 65(4): 3404–3419. Published online 2022 Feb 15. doi: 10.1021/acs.jmedchem.1c01934

PMCID:: PMC9165018

Abstract Article PDF–1.0M

Select item 92349618.

Improved Binding Affinity and Pharmacokinetics Enable Sustained Degradation of BCL6 In Vivo

Rosemary Huckvale, Alice C. Harnden, Kwai-Ming J. Cheung, Olivier A. Pierrat, Rachel Talbot, Gary M. Box, Alan T. Henley, Alexis K. de Haven Brandon, Albert E. Hallsworth, Michael D. Bright, Hafize Aysin Akpinar, Daniel S. J. Miller, Dalia Tarantino, Sharon Gowan, Angela Hayes, Emma A. Gunnell, Alfie Brennan, Owen A. Davis, Louise D. Johnson, Selby de Klerk, Craig McAndrew, Yann-Vaï Le Bihan, Mirco Meniconi, Rosemary Burke, Vladimir Kirkin, Rob L. M. van Montfort, Florence I. Raynaud, Olivia W. Rossanese, Benjamin R. Bellenie, Swen Hoelder

J Med Chem. 2022 Jun 23; 65(12): 8191–8207. Published online 2022 Jun 2. doi: 10.1021/acs.jmedchem.1c02175

PMCID:: PMC9234961

Abstract Article PDF–2.6M

Select item 107538609.

Identification of Novel Tetrahydroquinoxaline Derived Phenyl Ureas as Modulators of the Hepatitis B Virus Nucleocapsid Assembly

Nicky Hwang, Shuo Wu, Haiqun Ban, Huixin Luo, Julia Ma, Junjun Cheng, Qiong Zhao, Jessilyn A. Laney, Na Du, Junyang Guo, Manasa Suresh, Liangxian Shen, Gideon Tolufashe, Usha Viswanathan, John Kulp, Patrick Lam, Jinhong Chang, Jason Clement, Stephan Menne, Ju-Tao Guo, Yanming Du

Eur J Med Chem. Author manuscript; available in PMC 2024 Nov 5.

Published in final edited form as: Eur J Med Chem. 2023 Nov 5; 259: 115634. Published online 2023 Jul 17. doi: 10.1016/j.ejmech.2023.115634

PMCID:: PMC10753860

Abstract Article PDF–1.7M

Select item 1015729910.

Structure-activity relationship studies of antimalarial Plasmodium proteasome inhibitors – Part II

Hao Zhang, John Ginn, Wenhu Zhan, Annie Leung, Yi J. Liu, Akinori Toita, Rei Okamoto, Tzu-Tshin Wong, Toshihiro Imaeda, Ryoma Hara, Mayako Michino, Takafumi Yukawa, Sevil Chelebieva, Patrick K. Tumwebaze, Jeremie Vendome, Thijs Beuming, Kenjiro Sato, Kazuyoshi Aso, Philip J. Rosenthal, Roland A. Cooper, Nigel Liverton, Michael Foley, Peter T. Meinke, Carl F. Nathan, Laura A. Kirkman, Gang Lin

J Med Chem. Author manuscript; available in PMC 2024 Jan 26.

Published in final edited form as: J Med Chem. 2023 Jan 26; 66(2): 1484–1508. Published online 2023 Jan 11. doi: 10.1021/acs.jmedchem.2c01651

PMCID:: PMC10157299

Abstract Article PDF–2.0M

Select item 781619711.

Structure–Activity Relationship Studies of Pyrimidine-4-Carboxamides as Inhibitors of N-Acylphosphatidylethanolamine Phospholipase D

Elliot D. Mock, Ioli Kotsogianni, Wouter P. F. Driever, Carmen S. Fonseca, Jelle M. Vooijs, Hans den Dulk, Constant A. A. van Boeckel, Mario van der Stelt

J Med Chem. 2021 Jan 14; 64(1): 481–515. Published online 2020 Dec 31. doi: 10.1021/acs.jmedchem.0c01441

PMCID:: PMC7816197

Abstract Article PDF–3.2M

Select item 791373612.

Identification and Analytical Characterization of a Novel Synthetic Cannabinoid-Type Substance in Herbal Material in Europe

Emmanouil D. Tsochatzis, Joao Alberto Lopes, Margaret V. Holland, Fabiano Reniero, Giovanni Palmieri, Claude Guillou

Molecules. 2021 Feb; 26(4): 793. Published online 2021 Feb 3. doi: 10.3390/molecules26040793

PMCID:: PMC7913736

Abstract Article PDF–4.3M

Select item 776900813.

Identification of a New Heterocyclic Scaffold for Inhibitors of the Polo-Box Domain of Polo-like Kinase 1

Celeste N. Alverez, Jung-Eun Park, Kiran S. Toti, Yangliu Xia, Kristopher W. Krausz, Ganesha Rai, Jeong K. Bang, Frank J. Gonzalez, Kenneth A. Jacobson, Kyung S. Lee

J Med Chem. Author manuscript; available in PMC 2021 Nov 25.

Published in final edited form as: J Med Chem. 2020 Nov 25; 63(22): 14087–14117. Published online 2020 Nov 11. doi: 10.1021/acs.jmedchem.0c01669

PMCID:: PMC7769008

Abstract Article PDF–2.4M

Select item 658392414.

Development of a radioligand for imaging V_1a vasopressin receptors with PET

Ravi Naik, Heather Valentine, Andrew Hall, William B. Mathews, James C. Harris, C. Sue Carter, Robert F. Dannals, Dean F. Wong, Andrew G. Horti

Eur J Med Chem. Author manuscript; available in PMC 2019 Jun 19.

Published in final edited form as: Eur J Med Chem. 2017 Oct 20; 139: 644–656. Published online 2017 Aug 18. doi: 10.1016/j.ejmech.2017.08.037

PMCID:: PMC6583924

Abstract Article PDF–965K

Select item 633520015.

Optimization of isothiazolo[4,3-b]pyridine-based inhibitors of cyclin G associated kinase (GAK) with broad-spectrum antiviral activity

Szu-Yuan Pu, Randy Wouters, Stanford Schor, Jef Rozenski, Rina Barouch Bentov, Laura I. Prugar, Cecilia M. O’Brien, Jennifer M. Brannan, John M. Dye, Piet Herdewijn, Steven De Jonghe, Shirit Einav

J Med Chem. Author manuscript; available in PMC 2019 Jul 26.

Published in final edited form as: J Med Chem. 2018 Jul 26; 61(14): 6178–6192. Published online 2018 Jul 16. doi: 10.1021/acs.jmedchem.8b00613

PMCID:: PMC6335200

Abstract Article PDF–1.0M

Select item 1015254316.

Design, synthesis, and optimization of macrocyclic peptides as species-selective antimalaria proteasome inhibitors

Hao Zhang, John Ginn, Wenhu Zhan, Yi J. Liu, Annie Leung, Akinori Toita, Rei Okamoto, Tzu-Tshin Wong, Toshihiro Imaeda, Ryoma Hara, Takafumi Yukawa, Mayako Michino, Jeremie Vendome, Thijs Beuming, Kenjiro Sato, Kazuyoshi Aso, Peter T. Meinke, Carl F. Nathan, Laura A. Kirkman, Gang Lin

J Med Chem. Author manuscript; available in PMC 2023 Jul 14.

Published in final edited form as: J Med Chem. 2022 Jul 14; 65(13): 9350–9375. Published online 2022 Jun 21. doi: 10.1021/acs.jmedchem.2c00611

PMCID:: PMC10152543

Abstract Article PDF–1.5M

Select item 607174317.

Pyrazolo[3,4-d]pyrimidines as sigma-1 receptor ligands for the treatment of pain. Part 2: Introduction of cyclic substituents in position 4

José Luis Díaz, Jordi Corbera, Daniel Martínez, Magda Bordas, Cristina Sicre, Rosalia Pascual, Mª José Pretel, Ana Paz Marín, Ana Montero, Albert Dordal, Inés Alvarez, Carmen Almansa

Medchemcomm. 2017 Jun 1; 8(6): 1246–1254. Published online 2017 Apr 20. doi: 10.1039/c7md00078b

PMCID:: PMC6071743

Abstract Article PDF–1.2M

Select item 837297918.

Medicinal chemistry optimization of a diaminopurine chemotype: Towards a lead for Trypanosoma brucei inhibitors

Baljinder Singh, Rosario Diaz-Gonzalez, Gloria Ceballos-Perez, Domingo I. Rojas-Barros, Naresh Gunaganti, Kirsten Gillingwater, Maria Santos Martinez-Martinez, Pilar Manzano, Miguel Navarro, Michael P. Pollastri

J Med Chem. Author manuscript; available in PMC 2021 Sep 10.

Published in final edited form as: J Med Chem. 2020 Sep 10; 63(17): 9912–9927. Published online 2020 Aug 13. doi: 10.1021/acs.jmedchem.0c01017