Design, synthesis and biological evaluation of some 2-(6-nitrobenzo[d]thiazol-2-ylthio)-N-benzyl-N-(6-nitrobenzo[d]thiazol-2-yl)acetamide derivatives as selective DprE1 inhibitors

Recent Advances of DprE1 Inhibitors against Mycobacterium tuberculosis: Computational Analysis of Physicochemical and ADMET Properties

“…These results reveal conclusively that antimycobacterial efficacy significantly depends on the inhibition of the flavoenzyme DprE1. Several of these inhibitors were investigated for cytotoxicity in various human cell lines, including A549, ,,,, HeLa, , HepG2, ,,,,,,,,− ,, J-774, THP-1, and Vero cell lines. ,− ,,− ,,,,,,, A small negative correlation ( r = −0.291, p = 0.011, Figure B) was found between the experimental cytotoxicity concentrations (CC 50 ) and MIC, for covalent binders. This observation suggests that even the most effective covalent binders appear to display a safe profile, encouraging the ongoing search for novel inhibitors.…”

“…To investigate the molecular diversity and ADMET properties of the DprE1 inhibitors disclosed in this review, we collected a data set of a total of 1519 structurally diverse molecules by reviewing the literature from the year 2009 to April 2022. − ,− …”

“…These results reveal conclusively that antimycobacterial efficacy significantly depends on the inhibition of the flavoenzyme DprE1. Several of these inhibitors were investigated for cytotoxicity in various human cell lines, including A549, 64 , 67 , 77 , 82 , 83 HeLa, 37 , 39 HepG2, 28 , 56 , 66 , 69 , 72 , 74 , 87 , 88 , 90 − 92 , 109 , 111 J-774, 111 THP-1, 60 and Vero cell lines. 9 , 37 − 42 , 44 , 47 − 49 , 51 , 52 , 54 , 98 , 108 , 113 , 119 A small negative correlation ( r = −0.291, p = 0.011, Figure 4 B) was found between the experimental cytotoxicity concentrations (CC 50 ) and MIC, for covalent binders.…”

Recent advances in the synthesis of new benzothiazole based anti-tubercular compounds

“…Finally 2-(6-nitrobenzo[ d ]thiazol-2-ylthio)- N -benzyl- N -(6-nitrobenzo[ d ]thiazol-2-yl)acetamide derivatives 96a–o were formed after a series of reduction, acetylation and nucleophilic substitution (SN 2 ) reaction. 63…”

Pyrimidine Derivatives as Promising Candidates for Potent Antiangiogenic: A silico Study

“…22,23 The second objective of our study is to figure out a new activity of previously synthesized compounds with pyrimidine ring such as [1,2,3-selenadiazole, 1,2,3-thiadiazole, benzo[d]thiazol-2-ylthio] and thiophenyl compounds. 24 These compounds have been studied are organosulfur and organoselenium compounds which have significant activity as anti-fungal activity, 24 antibacterial effect, [25][26][27][28][29][30] due to the patients with cancer that suffering from microbial infections, 31 so the most significant features will be emphasized in this article for pyrimidine with the substitutions that mentioned using a potent anticancer and antimicrobial activities to produce a single drug with double activities to add a new cost-effective feature. Consequently, merged the pyrimidine with fourth substitutions to discover in silico a new activity and to get more potent binding energy with vascular endothelial growth factor receptor protein.…”