Polypharmacology allows scientists to explore novel therapeutic purposes for existing drugs and opens new doors to treat ...

A recent study shows that computer algorithms can be used to find molecules that can be developed into anti-inflammatory drugs. In the article, the researchers also describe how the same strategy can ...

Kenneth and colleagues can use this new tool to predict where to target drugs that would best block its replication, and how to design those drugs. Though we already have antivirals for COVID-19 ...

Alongside new steps in its therapeutic pipeline—and a new push into laboratory robotics—Insilico Medicine has raised $110 ...

Despite this remarkable progress, AI-powered drug design is still in its infancy ... tissue distribution and off-target side effects. Meanwhile, there are other problems endemic to the pharmaceutical ...

“This is an important moment for the pharmaceutical industry and AI – Rentosertib is the first drug whose target and design were discovered by modern generative AI and now it has achieved an official ...

Structure-based drug design is the design and optimization of ... its shape and charge cause it to interact with its biological target, ultimately eliciting a medical effect.

Kenneth and colleagues can use this new tool to predict where to target drugs that would best block its replication, and how to design those drugs. Though we already have antivirals for COVID-19 ...

AI-powered tools like Merck’s Aiddison can accelerate drug identification and optimise design, cutting both costs and time to ...

These findings demonstrate new ways for glues to be used to target proteins traditionally considered undruggable, like CoREST, providing new strategies for drug design. "How this small molecule ...