Design, synthesis and mechanistic study of new benzenesulfonamide derivatives as anticancer and antimicrobial agents <i>via</i> carbonic anhydrase IX inhibition
Mohamed T. M. Nemr, Asmaa M. AboulMagd, Hossam M. Hassan, Ahmed A. Hamed, Mohamed I. A. Hamed, Mohammed T. El‐Saadi
Abstract
. Furthermore, the designed compounds were docked into CA IX (human) protein (PDB ID: 5FL6) and molecular modeling studies revealed favorable binding interactions for the active inhibitors. Finally, the predictive ADMET studies showed that, compounds 4e, 4g and 4h possessed promising pharmacokinetic properties.
Topics & Concepts
Carbonic anhydraseChemistryCell cultureGrowth inhibitionCancer cellEnzymeApoptosisCell growthAnnexinIC50BiochemistryCancer researchCancerIn vitroBiologyInternal medicineMedicineGeneticsEnzyme function and inhibitionSynthesis and Catalytic ReactionsCholinesterase and Neurodegenerative Diseases