Hot spot-driven discovery of β-catenin/Tcf4 interaction inhibitors via virtual drug repurposing study and experimental validation in colorectal cancer cells.
Findings provide compelling evidence for the feasibility of targeting β-catenin/Tcf4 interactions using small molecules and suggest that Carbenicillin and Ceforanide may serve as promising repurposed candidates for therapeutic intervention in Wnt-driven malignancies.
These findings position ZINC7263 as a novel, potent SMO inhibitor with a stable binding affinity, dynamic interaction stability, and promising preclinical potential for targeting Hh-driven cancers.
Arpit Sharma, Alok Shukla, S. Raut et al.· Computational biology and ch...· 0 citations
Aberrant activation of the Hippo–YAP/TAZ–TEAD transcriptional axis is a recurrent feature of multiple solid tumors and contributes to tumor maintenance, lineage plasticity, and therapeutic resistance. Recent medicinal chemistry has shown that TEAD proteins are druggable, but the rate at which in silico screening nomina...
Glen J. Weiss, Joseph C. Loftus, D. Mallery et al.· Frontiers in Oncology· 0 citations
A number of lead candidates with strong EGFR inhibitory potential, promising pharmacokinetic profiles, and mutant selectivity were successfully identified by the integrated computational approach.
M. Kendre, S. S. Bhusari, Pravin S. Wakte· Journal of Pharmaceutical In...· 0 citations
Tingenone is identified as a promising scaffold for the development of new c-Myb-CBP/p300 KIX PPI inhibitors, having produced the clearest signatures of interfacial weakening and the most favorable disruption metrics.
Emadeldin M. Kamel, H. Rudayni, A. A. Allam et al.· Journal of Molecular Graphic...· 0 citations
G856-6814 is supported as a NAT10-targeting inhibitory scaffold that requires broader selectivity and in vivo evaluation and attenuation of cellular effects after NAT10 knockdown.
Chao Xu, Shi-Lei Zhao, Bing Xu et al.· Journal of Computer-Aided Mo...· 0 citations
A large amount of XLJD and every three flavonoids significantly reduced the mRNA expression of the five hub genes in HT-29 cells; however, the low-concentration group had little to no effect.
Ning Du, L. Ji, Li-Xing Liu et al.· Frontiers in Oncology· 0 citations
We use cookies to run the site and, with your consent, for analytics and to show ads.
See our Cookie Policy.