Computer-aided drug design of bioactive natural products

V Prachayasittikul, A Worachartcheewan… - Current Topics in …, 2015 - ingentaconnect.com
Natural products have been an integral part of sustaining civilizations because of their
medicinal properties. Past discoveries of bioactive natural products have relied on …

Interaction of triterpenoids with human serum albumin: A review

R Abboud, C Charcosset, H Greige-Gerges - Chemistry and Physics of …, 2017 - Elsevier
Triterpenoids are a large group of natural and synthetic products. This review deals with the
current state of knowledge on their interaction with serum albumin. The binding of drugs to …

Stability analysis of the asiatic acid-COX-2 complex using 100 ns molecular dynamic simulations and its selectivity against COX-2 as a potential anti-inflammatory …

I Musfiroh, RE Kartasasmita, S Ibrahim, M Muchtaridi… - Molecules, 2023 - mdpi.com
Asiatic acid, a triterpenoid compound, has been shown to have anti-inflammatory activity
through the inhibition of the formation of cyclooxygenase-2 (COX-2) in vitro and in vivo. This …

Malarial inflammation-driven pathophysiology and its attenuation by triterpene phytotherapeutics

GA Mavondo, BN Mkhwanazi… - Parasitol Microbiol …, 2019 - books.google.com
Malaria driven pathophysiology inimically conjoined to systemic inflammation response
cascade in a vicious feed-forward cycle destined to a terrible debilitation or demise of the …

Pre-infection administration of asiatic acid retards parasitaemia induction in Plasmodium berghei murine malaria infected Sprague-Dawley rats

GA Mavondo, BN Mkhwananzi, MV Mabandla - Malaria Journal, 2016 - Springer
Background Malaria prevention has remained a critical area in the absence of efficacious
vaccines against malaria. Drugs currently used as chemotherapeutics are also used in …

[HTML][HTML] Hydrazones derived from natural aldehydes: in vitro cytotoxic evaluation and in silico pharmacokinetic predictions

VL dos Anjos Santos, A de Assis Gonsalves… - … de Ciencias Químico …, 2021 - scielo.org.co
Aim: To evaluate the anticancer activity in vitro and the pharmacokinetic profile of six
synthesized hydrazonic compounds, identified as vanillin 1-phthalazinylhydrazone (VAN-1); …

[PDF][PDF] Binding affinity of omega 3 fatty acid as an agonist PPAR-γ and GPR120 receptor for obesity using molecular docking and ADME prediction

G Megawati, D Herawati, I Musfiroh - Eur J Mol Clin Med, 2021 - academia.edu
Obesity is a complex disease involving excessive amounts of body fat due to problems with
lipid metabolism and catalysis by PPARγ and GPR120. It is currently known that full-agonist …

Osteogenic induction of asiatic acid derivatives in human periodontal ligament stem cells

S Thamnium, C Laomeephol, P Pavasant… - Scientific reports, 2023 - nature.com
Asiatic acid (AA) and asiaticoside, pentacyclic triterpenoid compounds derived from Centella
asiatica, are known for their biological effects in promoting type I collagen synthesis and …

[HTML][HTML] Antimalarial phytochemicals: Delineation of the triterpene asiatic acid malarial anti-disease and pathophysiological remedial activities-part I

GA Mavondo, I Kasvosve - Journal of Infectious Diseases and …, 2018 - fulltext.scholarena.co
Antimalarial Phytochemicals: Delineation of the Triterpene Asiatic Acid Malarial Anti-Disease
and Pathophysiological Remedial Activities - Part I | Journal of Infectious Diseases and …

[PDF][PDF] Molecular dynamic simulation of asiatic acid derivatives complex with inducible nitric oxide synthase enzyme as an anti-inflammatory

I Musfiroh, H Khatami, S Megantara… - Int. J. Appl. Pharm, 2021 - academia.edu
Objective: The aim of this study was to determine the stability interaction of asiatic acid
derivatives (AA) complex with inducible nitric oxide synthase (iNOS) enzyme as an anti …