Tim Knehans

Frankfurter Str. 250
Darmstadt, HE 64293, Germany

Last Updated: 09/26/2026

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Found 9 publications

Exploiting high-energy hydration sites for the discovery of potent peptide aldehyde inhibitors of the SARS-CoV-2 main protease with cellular antiviral activity.

Exploiting high-energy hydration sites for the discovery of potent peptide aldehyde inhibitors of the SARS-CoV-2 main protease with cellular antiviral activity.

Journal: Bioorganic & medicinal chemistry

Published: November 28, 2023

Discovery of Cycloalkyl[c]thiophenes as Novel Scaffolds for Hypoxia-Inducible Factor-2α Inhibitors.

Discovery of Cycloalkyl[c]thiophenes as Novel Scaffolds for Hypoxia-Inducible Factor-2α Inhibitors.

Journal: Journal of medicinal chemistry

Published: July 05, 2023

An ABSINTH-Based Protocol for Predicting Binding Affinities between Proteins and Small Molecules.

An ABSINTH-Based Protocol for Predicting Binding Affinities between Proteins and Small Molecules.

Journal: Journal of chemical information and modeling

Published: September 08, 2020

Large-Scale Assessment of Binding Free Energy Calculations in Active Drug Discovery Projects.

Large-Scale Assessment of Binding Free Energy Calculations in Active Drug Discovery Projects.

Journal: Journal of chemical information and modeling

Published: August 20, 2020

Site-Specific Conjugation of Native Antibodies Using Engineered Microbial Transglutaminases.

Site-Specific Conjugation of Native Antibodies Using Engineered Microbial Transglutaminases.

Journal: Bioconjugate chemistry

Published: March 06, 2020

Discovery of a Locally and Orally Active CXCL12 Neutraligand (LIT-927) with Anti-inflammatory Effect in a Murine Model of Allergic Airway Hypereosinophilia.

Discovery of a Locally and Orally Active CXCL12 Neutraligand (LIT-927) with Anti-inflammatory Effect in a Murine Model of Allergic Airway Hypereosinophilia.

Journal: Journal of medicinal chemistry

Published: August 15, 2018

Iriomoteolides: novel chemical tools to study actin dynamics.

Iriomoteolides: novel chemical tools to study actin dynamics.

Journal: Chemical science

Published: October 02, 2017

Correction to Concurrent Cooperativity and Substrate Inhibition in the Epoxidation of Carbamazepine by Cytochrome P450 3A4 Active Site Mutants Inspired by Molecular Dynamics Simulations.

Correction to Concurrent Cooperativity and Substrate Inhibition in the Epoxidation of Carbamazepine by Cytochrome P450 3A4 Active Site Mutants Inspired by Molecular Dynamics Simulations.

Journal: Biochemistry

Published: September 22, 2016

Concurrent cooperativity and substrate inhibition in the epoxidation of carbamazepine by cytochrome P450 3A4 active site mutants inspired by molecular dynamics simulations.

Concurrent cooperativity and substrate inhibition in the epoxidation of carbamazepine by cytochrome P450 3A4 active site mutants inspired by molecular dynamics simulations.

Journal: Biochemistry

Published: December 30, 2014

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Last Updated: 09/26/2026