Generating Novel Linker Structures in Antibody-Drug Conjugates with Diffusion Models
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A Cao, JY Chen
International Conference on Artificial Intelligence in …, 2025
Springer
Antibody-drug conjugates (ADCs) are innovative cancer therapies composed of three main components: a monoclonal antibody, payload, and linker. The linker plays a crucial role in ADC pharmacokinetics and payload release. Current challenges in linker design stem from the need to balance complex requirements, including stability, controlled release, toxicity profile, biological context, linker length, and steric hindrance. Leveraging computational tools, particularly generative models, offers a path to explore chemical space and design …
