MedChemComm · 2013 · 15 citations · 26 references
PharmacyMedicinal ChemistryPharmacologyDrug DesignDrug DiscoveryStructure-activity RelationshipsHeterocyclic ChemistryHit-to-lead OptimizationLead Compound DesignMolecular DockingProtein-ligand DockingStructure-activity Relationship AnalysisCarbazole SynthesisCytotoxicity AssaysDocking StudiesDocking-based Drug DesignHeterocyclic Medicinal ChemistryKinase InhibitorsMolecular Docking Of InhibitorsProtein Kinase Inhibitors
The newly synthesized hetero annulated carbazoles were prepared in good yields and structurally characterized by all spectral means. The in vitro cytotoxicity was evaluated for all the synthesized compounds by MTT (3-(4,5-dimethylthiazol-2-yl)-2,5-diphenyltetrazolium bromide) assay against HeLa and MCF 7 and compared with the standard drug ellipticine. Compound 5b outperformed the standard drug ellipticine. All the compounds showed moderate to potent activity against the cell lines. The preliminary structure–activity relationships were carried out. In order to understand the nature of interactions of these molecules we carried out molecular docking studies using the protein kinase CK2 inhibitors. The docking results provided some useful information for the future design of more potent inhibitors.
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Protein kinase CK2 in mammary gland tumorigenesis
Esther Landesman‐Bollag, Raphaëlle Romieu‐Mourez, Diane H. Song et al. · Oncogene · 2001 · 296 citations