CK1ε is a key regulator of WNT/β-catenin and other pathways that are linked to tumor progression; thus, CK1ε is considered a target for the development of antineoplastic therapies. In this study, we performed a virtual screening to search for potential CK1ε inhibitors. First, we characterized the dynamic noncovalent interactions profiles for a set of reported CK1ε inhibitors to generate a pharmacophore model, which was used to identify new potential inhibitors among FDA-approved drugs. We found that etravirine and abacavir, two drugs that are approved for HIV infections, can be repurposed as CK1ε inhibitors. The interaction of these drugs with CK1ε was further examined by molecular docking and molecular dynamics. Etravirine and abacavir formed stable complexes with the target, emulating the binding behavior of known inhibitors. However, only etravirine showed high theoretical binding affinity to CK1ε. Our findings provide a new pharmacophore for targeting CK1ε and implicate etravirine as a CK1ε inhibitor and antineoplastic agent.
A new species of Rhabdochona from 2 species of freshwater fishes, Alloophorus robustus and Goodea atripinnis, is described from 2 lakes of the Mesa Central of Mexico. Rhabdochona lichtenfelsi n. sp. belongs to a group of species possessing inconspicuous bifurcated deirids and a prostom armed with 10 large teeth. It is distinguished from them because the left spicule is shorter, the tip is bifurcate, and both spicules lack a reflected dorsal barb. The new species most closely resembles Rhabdochona catostomi and Rhabdochona milleri but differs from them because the former possesses a left spicule tip with ventral barb, right spicule with reflected distal barb, and 5 pairs of postanal papillae, whereas R. milleri has 14 prostomal teeth, eggs rounded, and left spicule with slightly outlined bifurcation and right with a dorsal barb. Previous records of R. milleri in Mexico must be referred to R. lichtenfelsi.
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