Chemoinformatics-based enumeration of chemical libraries: a tutorial
FI Saldívar-González, CS Huerta-García… - Journal of …, 2020 - Springer
Virtual compound libraries are increasingly being used in computer-assisted drug discovery
applications and have led to numerous successful cases. This paper aims to examine the …
applications and have led to numerous successful cases. This paper aims to examine the …
Design of κ-opioid receptor agonists for the development of potential treatments of pain with reduced side effects
F Santino, L Gentilucci - Molecules, 2023 - mdpi.com
The κ-opioid receptor (KOR) has recently emerged as an alternative therapeutic target for
the development of pain medications, without deleterious side effects associated with the μ …
the development of pain medications, without deleterious side effects associated with the μ …
Exploring the chemical space and the bioactivity profile of lactams: a chemoinformatic study
Lactams are a class of compounds important for drug design, due to their great variety of
potential therapeutic applications, spanning cancer, diabetes, and infectious diseases. So …
potential therapeutic applications, spanning cancer, diabetes, and infectious diseases. So …
Development of a selective peptide κ-opioid receptor antagonist by late-stage functionalization with cysteine staples
The κ-opioid receptor (KOR) is an attractive target for the development of novel drugs. KOR
agonists are potentially safer pain medications, whereas KOR antagonists are promising …
agonists are potentially safer pain medications, whereas KOR antagonists are promising …
Design of a stable cyclic peptide analgesic derived from sunflower seeds that targets the κ-opioid receptor for the treatment of chronic abdominal pain
E Muratspahić, N Tomašević… - Journal of medicinal …, 2021 - ACS Publications
The rising opioid crisis has become a worldwide societal and public health burden, resulting
from the abuse of prescription opioids. Targeting the κ-opioid receptor (KOR) in the …
from the abuse of prescription opioids. Targeting the κ-opioid receptor (KOR) in the …
Polymer‐Based Module for NAD+ Regeneration with Visible Light
The regeneration of enzymatic cofactors by cell‐free synthetic modules is a key step towards
producing a purely synthetic cell. Herein, we demonstrate the regeneration of the enzyme …
producing a purely synthetic cell. Herein, we demonstrate the regeneration of the enzyme …
Green synthesis of bioactive oligopeptides promoted by recyclable nanocrystalline hydroxyapatite
Aim: The pharmaceutical industry is showing renewed interest in therapeutic peptides.
Unfortunately, the chemical synthesis of peptides remains very expensive and problematic …
Unfortunately, the chemical synthesis of peptides remains very expensive and problematic …
Stereocontrolled access to δ-lactone-fused-γ-lactams bearing angular benzylic quaternary stereocenters
TK Beng, MJ Rodriguez, C Borg - RSC advances, 2022 - pubs.rsc.org
C-fused γ-lactam-lactones are resident in several bioactive molecules, including anticancer
agents such as omuralide. In this embodiment, we report mild conditions for the catalytic …
agents such as omuralide. In this embodiment, we report mild conditions for the catalytic …
Signaling underlying kappa opioid receptor-mediated behaviors in rodents
LY Liu-Chen, P Huang - Frontiers in Neuroscience, 2022 - frontiersin.org
Kappa opioid receptor (KOR) agonists are potentially useful as analgesic and anti-pruritic
agents, for prevention and treatment of substance use disorders, and for treatment of …
agents, for prevention and treatment of substance use disorders, and for treatment of …
Design, synthesis, and biological evaluation of the third generation 17-cyclopropylmethyl-3, 14β-dihydroxy-4, 5α-epoxy-6β-[(4′-pyridyl) carboxamido] morphinan …
μ opioid receptor (MOR) agonists have been widely applied for treating moderate to severe
pain. However, numerous adverse effects have been associated with their application …
pain. However, numerous adverse effects have been associated with their application …