For each of the below topics, a slot in the programme will be available for an oral communication to be selected out of the submitted abstracts.
- Session 1 : Methodologies to Understand Cellular Target Interaction
Session Chair : Prof. Per ARTURSSON, Uppsala University, Sweden
Exposure at the site of action and target engagement have been identified as two of the most important factors for success in drug discovery and the design of chemical probes. Knowledge about these factors are more important than ever, given that drug discovery programs have, to a great extent, shifted to intracellular targets. This, together with a renewed and expanded interest in new drug modalities with inherently poor membrane permeability has encouraged investigations into new methodologies to understand, improve and predict cellular target interaction. In this session, new approaches for improved prediction and understanding of intracellular exposure and target engagement are presented.
- Session 2 : The "Catalytic Cycle" of Complex Molecule Synthesis and Methodology Development
Session Chair : Prof. Tanja GAICH, University of Konstanz, Germany
Complex molecule synthesis and synthetic methodology development are closely entangled to each other.
In the past and present, research in either field have proven to strongly impact each other, thereby advancing the science of synthesis.
The session will highlight such advancements, provide insights into the ongoing challenges in the fields, and give an outlook and perspective on the direction taken by organic synthesis.
These advancements serve to meet the ever more increasing needs for diverse, tailor-made synthetic tools, to enable rationale and practical construction of complex organic architectures.
- Session 3 : Understanding PK and PK/PD Relationships in Drug Discovery - Small Molecule Target Mediated Drug Disposition
Session Chair : Dr Stephanie HARLFINGER, AstraZeneca, United Kingdom
- Session 4 : Synthesis of Small Rings or sp3 Rich Fragments
Session Chair : Dr James MOUSSEAU, Pfizer, United States
- Session 5 : Targeting Unstructured Proteins
Session Chair : Dr Hasane RATNI, F. Hoffmann-La Roche, Switzerland
- Session 6 : Covalent Targeting: Innovating for the Future
Session Chair : Dr Vishal VERMA, Genentech, Inc., United States
The increasing acceptance of covalently targeted warheads for drug discovery has opened doors to previously undruggable targets, such as KRAS G12C which now has multiple compounds progressing through the clinic. The vast majority of recently reported warheads utilize 1,4-Michael acceptors as electrophiles for reaction with cysteine, despite a long history of other types of warheads such as beta-lactam antibiotics. This seminar will seek to showcase examples of non-acrylamide warheads in the targeting of a variety of amino acid residues in order to continue to expand the range of druggable targets, including those beyond oncology. Medicinal chemistry considerations will include both Kd and kinact optimization as well as pharmacokinetics and safety applications.
- Session 7 : Automation and Machine Learning Applications for Medicinal Chemistry
Session Chair : Dr Michael WLEKLINSKI, Merck & Co., Inc., United States
- Session 8 : Drug Discovery Tales
Session Chair : Dr Nadia AHMAD, Charles River Laboratories, United Kingdom
This session will be put together by selected proposals out of the abstract submissions.