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1.
A consensus reverse docking approach for identification of a competitive inhibitor of acetyltransferase enhanced intracellular survival protein from Mycobacterium tuberculosis.
Bioorg Med Chem
; 108: 117774, 2024 Jun 15.
Artículo
en Inglés
| MEDLINE | ID: mdl-38833750
2.
Bradykinin promotes murine melanoma cell migration and invasion through endogenous production of superoxide and nitric oxide.
Nitric Oxide
; 132: 15-26, 2023 03 01.
Artículo
en Inglés
| MEDLINE | ID: mdl-36736618
3.
Computer-aided design of 1,4-naphthoquinone-based inhibitors targeting cruzain and rhodesain cysteine proteases.
Bioorg Med Chem
; 41: 116213, 2021 07 01.
Artículo
en Inglés
| MEDLINE | ID: mdl-33992862
4.
Metabolic flux analysis for metabolome data validation of naturally xylose-fermenting yeasts.
BMC Biotechnol
; 19(1): 58, 2019 08 05.
Artículo
en Inglés
| MEDLINE | ID: mdl-31382948
5.
Between Nonlinearities, Complexity, and Noises: An Application on Portfolio Selection Using Kernel Principal Component Analysis.
Entropy (Basel)
; 21(4)2019 Apr 07.
Artículo
en Inglés
| MEDLINE | ID: mdl-33267090
6.
Insights to Design New Drugs against Human African Trypanosomiasis Targeting Rhodesain using Covalent Docking, Molecular Dynamics Simulations, and MM-PBSA Calculations.
Curr Comput Aided Drug Des
; 2024 Jan 19.
Artículo
en Inglés
| MEDLINE | ID: mdl-38310575
7.
Potentiating-antibiotic activity and absorption, distribution, metabolism, excretion and toxicity properties (ADMET) analysis of synthetic thiadiazines against multi-drug resistant (MDR) strains.
Fundam Clin Pharmacol
; 38(1): 84-98, 2024 Feb.
Artículo
en Inglés
| MEDLINE | ID: mdl-37649138
8.
Would the Development of a Multitarget Inhibitor of 3CLpro and TMPRSS2 be Promising in the Fight Against SARS-CoV-2?
Med Chem
; 19(5): 405-412, 2023.
Artículo
en Inglés
| MEDLINE | ID: mdl-36221875
9.
Exploring N-myristoyltransferase as a promising drug target against parasitic neglected tropical diseases.
Eur J Med Chem
; 258: 115550, 2023 Oct 05.
Artículo
en Inglés
| MEDLINE | ID: mdl-37336067
10.
Targeting SmCB1: Perspectives and Insights to Design Antischistosomal Drugs.
Curr Med Chem
; 2023 Oct 25.
Artículo
en Inglés
| MEDLINE | ID: mdl-37921174
11.
Overview of the New Bioactive Heterocycles as Targeting Topoisomerase Inhibitors Useful Against Colon Cancer.
Anticancer Agents Med Chem
; 2023 Nov 30.
Artículo
en Inglés
| MEDLINE | ID: mdl-38038012
12.
The Power of Molecular Dynamics Simulations and Their Applications to Discover Cysteine Protease Inhibitors.
Mini Rev Med Chem
; 2023 Sep 01.
Artículo
en Inglés
| MEDLINE | ID: mdl-37680157
13.
The influence of N-alkyl chains in benzoyl-thiourea derivatives on urease inhibition: Soil studies and biophysical and theoretical investigations on the mechanism of interaction.
Biophys Chem
; 299: 107042, 2023 08.
Artículo
en Inglés
| MEDLINE | ID: mdl-37263179
14.
ACW-02 an Acridine Triazolidine Derivative Presents Antileishmanial Activity Mediated by DNA Interaction and Immunomodulation.
Pharmaceuticals (Basel)
; 16(2)2023 Jan 29.
Artículo
en Inglés
| MEDLINE | ID: mdl-37259353
15.
TNF-α Inhibitors from Natural Compounds: An Overview, CADD Approaches, and their Exploration for Anti-inflammatory Agents.
Comb Chem High Throughput Screen
; 25(14): 2317-2340, 2022.
Artículo
en Inglés
| MEDLINE | ID: mdl-34269666
16.
Computer-Aided Drug Design of Anti-inflammatory Agents Targeting Microsomal Prostaglandin E2 Synthase-1 (mPGES-1).
Curr Med Chem
; 29(33): 5397-5419, 2022.
Artículo
en Inglés
| MEDLINE | ID: mdl-35301943
17.
Molecular Modeling Targeting Transmembrane Serine Protease 2 (TMPRSS2) as an Alternative Drug Target Against Coronaviruses.
Curr Drug Targets
; 23(3): 240-259, 2022.
Artículo
en Inglés
| MEDLINE | ID: mdl-34370633
18.
Molecular Docking and Dynamics Simulations Studies of a Dataset of NLRP3 Inflammasome Inhibitors.
Recent Adv Inflamm Allergy Drug Discov
; 2022 Jan 26.
Artículo
en Inglés
| MEDLINE | ID: mdl-35081900
19.
Strategies in Medicinal Chemistry to Discover New Hit Compounds against Ebola Virus: Challenges and Perspectives in Drug Discovery.
Mini Rev Med Chem
; 22(22): 2896-2924, 2022.
Artículo
en Inglés
| MEDLINE | ID: mdl-35379146
20.
Advances in Computational Methods to Discover New NS2B-NS3 Inhibitors Useful Against Dengue and Zika Viruses.
Curr Top Med Chem
; 22(29): 2435-2462, 2022.
Artículo
en Inglés
| MEDLINE | ID: mdl-36415099