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9 results in Authors: Herbert Waldmann

Theoretical and Computational Chemistry

Working Paper

A compound-target pairs dataset: differences between drugs, clinical candidates and other bioactive compounds

A. Lina Heinzke, Barbara Zdrazil, Paul D. Leeson, Robert J. Young, Axel Pahl, Herbert Waldmann, Andrew R. Leach

Version 2 posted 11 March 2024

793

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Citations

Biological and Medicinal Chemistry

Working Paper

Identification of Lysosomotropism using Explainable Machine Learning and Morphological Profiling Cell Painting Data

Aishvarya Tandon, Anna Santura, Axel Pahl, Herbert Waldmann, Paul Czodrowski

Version 2 posted 08 December 2023

722

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Biological and Medicinal Chemistry

Working Paper

Occurrence of ‘Natural Selection’ in Successful Small Molecule Drug Discovery

Lina Heinzke, Axel Pahl, Barbara Zdrazil, Andrew Leach, Herbert Waldmann, Robert Young, Paul Leeson

Version 1 posted 25 March 2024

513

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Biological and Medicinal Chemistry

Working Paper

Discovery of a novel pseudo-natural product Aurora kinase inhibitor chemotype through morphological profiling

Herbert Waldmann, Lin Wang, Furkan Yilmaz, Okan Yildirim, Beate Schölermann, Sukdev Bag, Luca Greiner, Axel Pahl, Sonja Sievers, Rebecca Scheel, Carsten Strohmann, Daniel Foley, Slava Ziegler, Michael Grigalunas

Version 1 posted 22 November 2023

789

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Biological and Medicinal Chemistry

Working Paper

Discovery of a Drug-like, Natural Product-Inspired DCAF11 Ligand Chemotype

Gang Xue, Jianing Xie, Matthias Hinterndorfer, Marko Cigler, Hana Imrichova, Soheila Adariani, Lara Dötsch, Georg Winter, Herbert Waldmann

Version 1 posted 10 March 2023

2,117

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Citations

Biological and Medicinal Chemistry

Working Paper

Pseudo-Natural Products Occur Frequently in Biologically Relevant Compounds

Herbert Waldmann, José-Manuel Gally, Axel Pahl, Paul Czodrowski

Version 1 posted 27 July 2021

571

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Biological and Medicinal Chemistry

Working Paper

Spacial Score – A Comprehensive Topological Indicator for Small Molecule Complexity

Adrian Krzyzanowski, Axel Pahl, Michael Grigalunas, Herbert Waldmann

Version 1 posted 30 March 2023

437

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Biological and Medicinal Chemistry

Working Paper

Identification of Readily Available Pseudo-Natural Products

Axel Pahl, Oleksandr O. Grygorenko, Ivan S. Kondratov, Herbert Waldmann

Version 1 posted 27 March 2024

391

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Biological and Medicinal Chemistry

Working Paper

Covalent Modification of Glutamic Acid Inspired by HaloTag Technology

Herbert Waldmann, Ruirui Zhang, Jie liu, Raphael Gasper, Petra Janning

Version 1 posted 10 April 2025

330

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9 results in Herbert Waldmann in Authors: Herbert Waldmann

A compound-target pairs dataset: differences between drugs, clinical candidates and other bioactive compounds

Identification of Lysosomotropism using Explainable Machine Learning and Morphological Profiling Cell Painting Data

Occurrence of ‘Natural Selection’ in Successful Small Molecule Drug Discovery

Discovery of a novel pseudo-natural product Aurora kinase inhibitor chemotype through morphological profiling

Discovery of a Drug-like, Natural Product-Inspired DCAF11 Ligand Chemotype

Pseudo-Natural Products Occur Frequently in Biologically Relevant Compounds

Spacial Score – A Comprehensive Topological Indicator for Small Molecule Complexity

Identification of Readily Available Pseudo-Natural Products

Covalent Modification of Glutamic Acid Inspired by HaloTag Technology

9 results in Authors: Herbert Waldmann