Insight into the screening of potential beta-lactamase inhibitors as anti-bacterial chemical agents through pharmacoinformatics study

P Parida, S Bhowmick, A Saha… - Journal of Biomolecular …, 2021 - Taylor & Francis
Drug resistance is an unsolved and major concern in the bacterial infection. Continuous
development of drug-resistance to the antibiotics exponentially rises the danger of bacterial …

Identification of Phytochemicals with Inhibitory Potential Against Beta-lactamase Enzymes via Computer-aided Approach

GC Nwokebu, AB Adesina, CN Isibor, SA Aigbepue… - Bioorganic …, 2024 - Elsevier
Introduction Antibacterial drugs have been widely used for the past century to treat diseases,
but their efficacy has been limited by multi-resistant pathogens, particularly those that utilize …

[HTML][HTML] In silico study of inhibition effects of phytocompounds from four medicinal plants against the Staphylococcus aureus β-lactamase

F Etminani, A Etminani, SO Hasson, HK Judi… - Informatics in Medicine …, 2023 - Elsevier
Introduction This study aimed to evaluate new Staphylococcus aureus β-lactamase
inhibitors from medicinal plants Rosmarinus officinalis, Ocimum basilicum, Eucalyptus …

In-silico virtual screening for identification of potent inhibitor for L2-β-lactamase from Stenotrophomonas maltophilia through molecular docking, molecular dynamics …

R Sharma, D Jade, S Mohan, R Chandel… - Journal of …, 2021 - Taylor & Francis
Abstract Stenotrophomonas maltophilia, a Multiple-Drug-Resistant proteobacterium found in
healthy normal flora and fauna with an aerobic and non-fermentative respiratory process, is …

In-silico screening of Acacia pennata and Bridelia retusa reveals pinocembrin-7-O-β-D-glucopyranoside as a promising β-lactamase inhibitor to combat antibiotic …

AK Umar, D Roy, M Abdalla, Y Modafer… - Journal of …, 2023 - Taylor & Francis
The β-lactamase of Pseudomonas aeruginosa is known to degrade β-lactam antibiotics
such as penicillins, cephalosporins, monobactams, and carbapenems. With the discovery of …

In-Silico molecular screening of natural compounds as a potential therapeutic inhibitor for Methicillin-resistant Staphylococcus aureus inhibition

P Nandhini, PK Gupta, AK Mahapatra, AP Das… - Chemico-Biological …, 2023 - Elsevier
Methicillin-resistant Staphylococcus aureus (MRSA) is a life-threatening superbug causing
infectious diseases such as pneumonia, endocarditis, osteomyelitis, etc. Conventional …

Identification of natural inhibitor against L1 β-lactamase present in Stenotrophomonas maltophilia

D Jade, MA Harrison, S Sugumar - Journal of Molecular Modeling, 2022 - Springer
Antibiotic resistance is threatening the medical industry in treating microbial infections. Many
organisms are acquiring antibiotic resistance because of the continuous use of the same …

Repurposing FDA approved drug molecules against ABC classes of β-lactamases: a computational biology and molecular dynamics simulations study

N Farhat, AU Khan - Journal of Biomolecular Structure and …, 2023 - Taylor & Francis
Abstract β-lactamase are the main resistance factor for β-lactam antibiotics in Gram-negative
bacteria. Since β-lactam antibiotics are being utilised as an antimicrobial agents extensively …

Design of dipicolinic acid derivatives as New Delhi metallo-β-lactamase-1 inhibitors using a combined computational approach

X Wang, Y Gao, Y Yu, Y Yang, G Wang… - Journal of …, 2020 - Taylor & Francis
New Delhi metallo-β-lactamase (NDM-1) is the most recent addition to the class of metallo-β-
lactamases (MBLs). This enzyme leads to antibiotic resistance in clinical treatments owing to …

Discovery of potential inhibitors against New Delhi metallo-β-lactamase-1 from natural compounds: in silico-based methods

A Salari-Jazi, K Mahnam, P Sadeghi, MS Damavandi… - Scientific reports, 2021 - nature.com
New Delhi metallo-β-lactamase variants and different types of metallo-β-lactamases have
attracted enormous consideration for hydrolyzing almost all β-lactam antibiotics, which leads …