Tag: drug discovery

A new review in Letters in Functional Foods surveys how marine organisms yield drug candidates such as trabectedin and vidarabine ...

A new integrative review compiles evidence that the ornamental shrub Clerodendrum chinense, long used in traditional Asian and African medicine, ...

Chemists have designed nine 1,3,4-oxadiazole derivatives that inhibit breast cancer cells in vitro, with the lead compound R3 showing an ...

An integrated whole-genome and transcriptome study of the Asian buffalo leech has cataloged 72 known antithrombotic genes and identified 38 ...

Researchers have developed CCOT, a condition-controlled optimal transport framework that predicts single-cell responses to drug perturbations, including to compounds never ...

A new benchmark reveals that drug synergy prediction models often rely on memorizing historical data rather than learning generalizable pharmacological ...

A new computational Perspective argues that flavonoids, exemplified by the soy isoflavone daidzein, are a largely untapped and rationally designable ...

Researchers have built ProteinTalks, an AI virtual cell model trained on more than 38 million time-resolved protein measurements from perturbed ...

Chemists have fused pyrimidine and 1,3,4-oxadiazole rings into a new family of hybrid molecules, and the best member kills breast, ...

A reinforcement learning-based AI system called SyntheMol-RL designed easily synthesizable antibiotic candidates from a 46-billion-compound chemical space, yielding 13 potent ...