N. London

Dual Targeting of Histone Deacetylases and MYC as Potential Treatment Strategy for H3-K27M Pediatric Gliomas

This study investigates dual targeting of HDACs and MYC in H3-K27M pediatric gliomas, showing synergistic effects in reducing cell viability and tumor growth.

A simple method for developing lysine targeted covalent protein reagents

This paper develops a method to create covalent protein reagents targeting lysine residues using methacrylate esters, demonstrating their effectiveness in binding and stabilizing protein complexes.

Direct recruitment of Mis18 to interphase spindle poles promotes CENP-A chromatin assembly

The paper shows that Mis18 directly binds to SPB components to recruit Mis18C, promoting CENP-A chromatin assembly independently of centromeres.

An automatic pipeline for the design of irreversible derivatives identifies a potent SARS-CoV-2 Mpro inhibitor.

The paper introduces a computational pipeline to design irreversible inhibitors, identifying a potent SARS-CoV-2 Mpro inhibitor with low micromolar IC50.

Covalent Flexible Peptide Docking in Rosetta

The paper introduces CovPepDock, a computational pipeline for covalent peptide docking, and validates it by identifying potent electrophilic peptide binders.

Open Science Discovery of Potent Non-Covalent SARS-CoV-2 Main Protease Inhibitors

The paper describes an open-science drug discovery campaign that identified a non-covalent, non-peptidic inhibitor of SARS-CoV-2 main protease using crowdsourcing and computational methods.

PRosettaC: Rosetta based modeling of PROTAC mediated ternary complexes

PRosettaC models PROTAC ternary complexes using Rosetta, achieving near-native predictions and enabling PROTAC design for new targets.

Crystallographic and electrophilic fragment screening of the SARS-CoV-2 main protease

The paper identifies fragment hits against SARS-CoV-2 main protease using crystallography and mass spectrometry, revealing structural insights for drug design.

Sulfopin, a selective covalent inhibitor of Pin1, blocks Myc-driven tumor initiation and growth in vivo

Sulfopin, a selective Pin1 inhibitor, reduces tumor initiation and growth in neuroblastoma models by targeting c-Myc pathways.

Overcoming insecticide resistance through computational inhibitor design

The paper designs boronic acid inhibitors to overcome insecticide resistance by targeting carboxylesterases in pests, significantly enhancing insecticide efficacy and reducing usage.

Rapid covalent-probe discovery by electrophile fragment screening

This study develops a method for discovering covalent probes using electrophile fragment screening and identifies selective inhibitors for OTUB2 and NUDT7.