Discovery of novel rigid analogs of 2-naphthol with potent anticancer activity through multi-target topoisomerase I &amp; II and tyrosine kinase receptor EGFR &amp; VEGFR-2 inhibition mechanism

El-Mawgoud, Heba Kamal Abd; Fouda, Ahmed M.; El-Nassag, Mohammed A. A.; Elhenawy, Ahmed A.; Alshahrani, Mohammad Y.; El‐Agrody, Ahmed M.

doi:10.1016/j.cbi.2022.109838

Cited by 9 publications

(7 citation statements)

References 56 publications

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“…7). The bioactivity indices LE and Ki were also all within the expected range [44,45]. It is clear that molecular docking promoted antibacterial activity, which had an impact on the effectiveness of the docking experiment.…”

Section: Molecular Docking Pro Lementioning

confidence: 65%

New 1,3,4-Triaza-3H-indene Derivatives in Theoretical, Experimental and biological Studies

Ouzidan,

Hjouji,

Hafez

et al. 2024

Preprint

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6-Bromo-2-phenyl-1,3,4-triazaindan under solid-liquid catalysis-transfer-phase(CTP) environment, pyridine interacts with a number of halogenated derivatives to produce the anticipated regioisomer molecules 2a and 2b. Besides, the reaction of compound (1) with bis(2-chloroethyl) amine results in the corresponding isoxazolidin-2-one derivatives (3a) and (3b) at a satisfactory yield. The synthesized compounds are confirmed by X-ray diffraction, spectral techniques (1H NMR, 13C NMR). Then, 1,3,4-Triaza-3H-indene derivatives were analyzed in silico based on molecular structure by molecular docking analysis to determine which one could be used for in vitro antibacterial activity testing. The compounds with the highest binding efficiency in the docking experiment were chosen to be evaluated against both Gram-positive and Gram-negative bacteria. These compounds showed higher efficacy against Gram-positive bacteria than Gram-negative bacteria, which are much more resistant to them.

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Section: Molecular Docking Pro Lementioning

confidence: 65%

New 1,3,4-Triaza-3H-indene Derivatives in Theoretical, Experimental and biological Studies

Ouzidan,

Hjouji,

Hafez

et al. 2024

Preprint

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“…high capacity for transport. Together, these compounds have great potential for cancer therapy [57].…”

Section: Inhibiting Tumor Cellsmentioning

confidence: 99%

“…They were also characterized by good oral bioavailability and high capacity for transport. Together, these compounds have great potential for cancer therapy [ 57 ].…”

Section: New Potential Heterocyclic Molecular Targeted Drugsmentioning

confidence: 99%

Heterocyclic Molecular Targeted Drugs and Nanomedicines for Cancer: Recent Advances and Challenges

et al. 2023

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Cancer is a top global public health concern. At present, molecular targeted therapy has emerged as one of the main therapies for cancer, with high efficacy and safety. The medical world continues to struggle with the development of efficient, extremely selective, and low-toxicity anticancer medications. Heterocyclic scaffolds based on the molecular structure of tumor therapeutic targets are widely used in anticancer drug design. In addition, a revolution in medicine has been brought on by the quick advancement of nanotechnology. Many nanomedicines have taken targeted cancer therapy to a new level. In this review, we highlight heterocyclic molecular-targeted drugs as well as heterocyclic-associated nanomedicines in cancer.

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“…Compound 4 has a chiral feature; consequently, this specific rotation was gauged, utilizing a Carl Zeiss polarimeter to attribute the stereochemistry of the 1-position to the 1H-benzo[f ]-chromene moiety. Results revealed that compound 4 has zero rotation (meaning the molecule is optically inactive) and is obtained in the form of a racemic (±) mixture [26][27][28], as illustrated in Scheme 1.…”

Section: Optical Activitymentioning

confidence: 99%

“…The comprehensive biomedical features of chromene molecules have motivated scientific figures within the drug discovery biosphere to cultivate new derivatives of this class of materials and explore their novel biological characteristics. Chromenes have been renowned for their incredible biological functions, which assisted their assimilation into various applications such as antimicrobial activities [10][11][12][13][14], hypolipidemic [15], antileishmanial, antiviral, anti-HIV, antianaphylactic activities [16][17][18], insecticidal [19], targeting of c-Src kinase enzyme [20,21], anticancer and cytotoxic activities [22][23][24][25], cell cycle analysis, apoptotic effects, caspase 3/7, and inhibition of the topoisomerase enzyme [26][27][28][29][30][31][32][33]. Among the synthetic strategies to acquire chromene molecules, microwave irradiation is one of the most efficacious and eco-friendly procedures, which facilitates the isolation of the desired compounds in a short period of time and results in good yields [34][35][36][37].…”

Section: Introductionmentioning

confidence: 99%

The Crystal Structure of 3-Amino-1-(4-Chlorophenyl)-9-Methoxy-1H-Benzo[f]Chromene-2-Carbonitrile: Antimicrobial Activity and Docking Studies

et al. 2022

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Compound 3-amino-1-(4-chlorophenyl)-9-methoxy-1H-benzo[f]chromene-2-carbonitrile (4), was synthesized via the reaction of 7-methoxynaphthalen-2-ol (1), 4-chlorobenzaldehyde (2), and malononitrile (3) in an ethanolic piperidine solution under microwave irradiation. The synthesized pyran derivative 4 was asserted through spectral data and X-ray diffraction. The molecular structure of compound 4 was established unambiguously through the single crystal X-ray measurements and crystallized in the Triclinic, P-1, a = 8.7171 (4) Å, b = 10.9509 (5) Å, c = 19.5853 (9) Å, α = 78.249 (2)°, β = 89.000 (2)°, γ = 70.054 (2)°, V = 1717.88 (14) Å3, Z = 4. The target molecule has been screened for antibacterial and antifungal functionality. Compound 4 exhibited favorable antimicrobial activities that resembled the reference antimicrobial agents with an IZ range of 16–26 mm. In addition, MIC, MBC, and MFC were assessed and screened for molecule 4, revealing bactericidal and fungicidal effects. Lastly, a molecular docking analysis was addressed and conducted for this desired molecule.

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Discovery of novel rigid analogs of 2-naphthol with potent anticancer activity through multi-target topoisomerase I & II and tyrosine kinase receptor EGFR & VEGFR-2 inhibition mechanism

Cited by 9 publications

References 56 publications

New 1,3,4-Triaza-3H-indene Derivatives in Theoretical, Experimental and biological Studies

New 1,3,4-Triaza-3H-indene Derivatives in Theoretical, Experimental and biological Studies

Heterocyclic Molecular Targeted Drugs and Nanomedicines for Cancer: Recent Advances and Challenges

The Crystal Structure of 3-Amino-1-(4-Chlorophenyl)-9-Methoxy-1H-Benzo[f]Chromene-2-Carbonitrile: Antimicrobial Activity and Docking Studies

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