The world of drug discovery is getting a high-tech makeover. A new method called PoLiGenX is shaking things up. It uses a clever trick called latent-conditioned, target-aware equivariant diffusion. This fancy term means it can create new molecules that fit perfectly into specific parts of proteins. The process is smart. It looks at existing molecules in a protei...
Breast cancer is a big problem for women all around the world. It is the leading cause of death for women. This is why finding new ways to treat it is so important. One exciting approach combines smart technology with biology. The idea is to use advanced computing methods to improve how well certain medicines work. These medicines target a specific part of cells...
The quest for new medicines is a marathon, not a sprint. It is a costly and time-consuming process with a high failure rate. Scientists are always on the hunt for new methods to make drug discovery more efficient. One promising approach is de novo drug design. This method has gained traction in the past decade because it can explore vast chemical spaces and create hi...
Cancer is a major health issue worldwide, largely due to the rapid spread of abnormal cells. These cells often form tumors, like carcinomas, which come from epithelial cells growing out of control. Tumors release growth factors such as FGF and VEGF. These factors help new blood vessels form, a process called angiogenesis. This process is crucial for tumor growth and ...
Azetidines are small molecules that are very useful in making medicines. Scientists have found a new way to create these molecules using light and chemicals that flow. This method is quite flexible. It can make tiny amounts, like milligrams, or large amounts, like multigrams, of azetidines. The process starts with azetidine-2-carboxylic acids. These acids are changed...
The field of medicine is excited about a new approach to treating diseases. This method involves breaking down harmful proteins rather than just stopping them from working. This is a big deal because it can tackle proteins that were once thought to be impossible to target. This approach is called PROTACs, and it's changing the game in areas like cancer treatment, imm...
Osteoarthritis is a widespread condition that affects many people. Unfortunately, there are few effective treatments besides surgery. This is where molecular docking comes in. It's a technique used in drug discovery to find new compounds that can treat diseases. Until now, it hasn't been used to find new treatments for osteoarthritis. Researchers took 51 compounds t...
Fungi are amazing. They make all sorts of useful stuff. These compounds are like nature's medicine cabinet, full of potent ingredients. Scientists have been digging into marine fungi because they make some of the strongest compounds out there. One such fungus is Penicillium rubens YAP001. It was found living on a type of sea anemone. Researchers wanted to see if they...
Inflammation is a tricky thing. It's like a double-edged sword. It helps the body fight infections and heal injuries, but it can also cause problems when it goes into overdrive. This is where natural products come in. Some plants have special compounds that can calm down inflammation. These compounds are like secret weapons hidden in nature. Scientists have ...
In the world of medicine, a huge milestone was reached in 2024. It was the 15th birthday of ChEMBL. It is a big deal because ChEMBL is a massive, free-to-use database. It is like a giant library filled with information about drugs and how they work. This library is hosted by the European Bioinformatics Institute (EMBL-EBI). It is a key player in the fields of che...