List of works - Tanja Schirmeister

A comparative study on the experimentally derived electron densities of three protease inhibitor model compounds

scientific article published on 2 May 2008

A new lead for nonpeptidic active-site-directed inhibitors of the severe acute respiratory syndrome coronavirus main protease discovered by a combination of screening and docking methods

scientific article

Allicin and derivates are cysteine protease inhibitors with antiparasitic activity

scientific article published on 6 August 2010

Anti-protease and Immunomodulatory Activities of Bacteria Associated with Caribbean Sponges

article by Paula Tabares et al published 11 January 2011 in Marine Biotechnology

Anti-trypanosomal activities and structural chemical properties of selected compound classes

scientific article

Antioxidant and anti-protease activities of diazepinomicin from the sponge-associated Micromonospora strain RV115

scientific article published on 8 October 2012

Asymmetric Disulfanylbenzamides as Irreversible and Selective Inhibitors of Staphylococcus aureus Sortase A

scientific article published on 02 March 2020

Atomistic insights into the inhibition of cysteine proteases: first QM/MM calculations clarifying the regiospecificity and the inhibition potency of epoxide- and aziridine-based inhibitors

scientific article

Atomistic insights into the inhibition of cysteine proteases: first QM/MM calculations clarifying the stereoselectivity of epoxide-based inhibitors

scientific article published on 20 August 2008

Aziridide-Based Inhibitors of Cathepsin L: Synthesis, Inhibition Activity, and Docking Studies

scientific article published on 01 October 2006

Aziridine-2,3-dicarboxylate inhibitors targeting the major cysteine protease of Trypanosoma brucei as lead trypanocidal agents

scientific article published on 3 March 2006

Aziridine-2,3-dicarboxylate-based cysteine cathepsin inhibitors induce cell death in Leishmania major associated with accumulation of debris in autophagy-related lysosome-like vacuoles.

scientific article

Aziridine-2,3-dicarboxylates, peptidomimetic cysteine protease inhibitors with antileishmanial activity

scientific article published on July 2006

Benchmark Study for the Cysteine-Histidine Proton Transfer Reaction in a Protein Environment: Gas Phase, COSMO, QM/MM Approaches.

scientific article published on 20 February 2013

Biochemistry and medicinal chemistry of the dengue virus protease

scientific article published on 30 September 2014

Bis-acridines as lead antiparasitic agents: structure-activity analysis of a discrete compound library in vitro

scientific article

Bistacrine derivatives as new potent antimalarials

scientific article

Bistacrines as potential antitrypanosomal agents.

scientific article

Blocking effect of a biotinylated protease inhibitor on the egress of Plasmodium falciparum merozoites from infected red blood cells

scientific article published in May 2005

Cathepsin B in antigen-presenting cells controls mediators of the Th1 immune response during Leishmania major infection

scientific article (publication date: September 2014)

Challenging Problems in Charge Density Determination: Polar Bonds and Influence of the Environment

article

Cis-Configured aziridines are new pseudo-irreversible dual-mode inhibitors of Candida albicans secreted aspartic protease 2.

scientific article published in February 2008

Comparison of the separation of aziridine isomers applying heptakis(2,3-di-O-methyl-6-sulfato)beta-CD and heptakis(2,3-di-O-acetyl-6-sulfato)beta-CD in aqueous and nonaqueous systems

scientific article published in October 2005

Constrained peptidomimetics as antiplasmodial falcipain-2 inhibitors

scientific article published on 10 June 2010

Cysteine Proteases and Their Inhibitors

scientific article published on 01 February 1997

Cytotoxicity of Endoperoxides from the Caribbean Sponge Plakortis halichondrioides towards Sensitive and Multidrug-Resistant Leukemia Cells: Acids vs. Esters Activity Evaluation.

scientific article published on 03 March 2017

Development and validation of a separation method for the diastereomers and enantiomers of aziridine-type protease inhibitors

article

Development of Novel Peptidomimetics Containing a Vinyl Sulfone Moiety as Proteasome Inhibitors

article

Development of a New Antileishmanial Aziridine-2,3-Dicarboxylate-Based Inhibitor with High Selectivity for Parasite Cysteine Proteases

scientific article

Development of antitrypanosomal and antiplasmodial nonpeptidic cysteine protease inhibitors based on N-protected-guanidino-furan and -pyrrole building blocks

scientific article published on 15 June 2011

Development of novel 1,4-benzodiazepine-based Michael acceptors as antitrypanosomal agents

scientific article published on 21 June 2016

Development of novel dipeptide-like rhodesain inhibitors containing the 3-bromoisoxazoline warhead in a constrained conformation.

scientific article published on 21 September 2015

Development of novel selective peptidomimetics containing a boronic acid moiety, targeting the 20S proteasome as anticancer agents

scientific article

Development of peptidomimetic boronates as proteasome inhibitors

article

Development of peptidomimetics with a vinyl sulfone warhead as irreversible falcipain-2 inhibitors.

scientific article published on 31 January 2008

Development of rhodesain inhibitors with a 3-bromoisoxazoline warhead

scientific article published on 15 November 2013

Dipeptidyl Enoates As Potent Rhodesain Inhibitors That Display a Dual Mode of Action

scientific article published on 14 July 2015

Dipeptidyl Nitroalkenes as Potent Reversible Inhibitors of Cysteine Proteases Rhodesain and Cruzain.

scientific article published on 21 September 2016

Effect of electron-withdrawing substituents on the epoxide ring: an experimental and theoretical electron density analysis of a series of epoxide derivatives

scientific article published on 20 January 2011

Effect of protease inhibitors on exflagellation in Plasmodium falciparum

scientific article

Electrostatic complementarity in pseudoreceptor modeling based on drug molecule crystal structures: the case of loxistatin acid (E64c)

Erfolgreiches Konzept: Proteasen als Zielstrukturen für Antiinfektiva. Neue Angriffspunkte in der Infektionstherapie

scientific article published on 01 January 2009

Evaluation of dipeptide nitriles as inhibitors of rhodesain, a major cysteine protease of Trypanosoma brucei

scientific article published on 15 November 2016

Evidence for substrate binding-induced zwitterion formation in the catalytic Cys-His dyad of the SARS-CoV main protease

scientific article published on 7 September 2014

Flavonoids as noncompetitive inhibitors of Dengue virus NS2B-NS3 protease: inhibition kinetics and docking studies

scientific article published on 19 December 2014

Fluorine Scan of Inhibitors of the Cysteine Protease Human Cathepsin L: Dipolar and Quadrupolar Effects in the π-Stacking of Fluorinated Phenyl Rings on Peptide Amide Bonds

scientific article published on 20 April 2016

Fly versus man: evolutionary impairment of nucleolar targeting affects the degradome of Drosophila's Taspase1.

scientific article published on 29 January 2015

GNPS-guided discovery of xylacremolide C and D, evaluation of their putative biosynthetic origin and bioactivity studies of xylacremolide A and B

scientific article published in 2021

Gold compounds as cysteine protease inhibitors: perspectives for pharmaceutical application as antiparasitic agents

scientific article

Identification of a new series of amides as non-covalent proteasome inhibitors.

scientific article published on 25 January 2014

Identification of a potential allosteric site of Golgi α-mannosidase II using computer-aided drug design

scientific article published on 08 May 2019

Identification of noncovalent proteasome inhibitors with high selectivity for chymotrypsin-like activity by a multistep structure-based virtual screening.

scientific article

Identification of plakortide E from the Caribbean sponge Plakortis halichondroides as a trypanocidal protease inhibitor using bioactivity-guided fractionation

scientific article published on 2 May 2014

Identification of the protease inhibitor miraziridine A in the Red sea sponge Theonella swinhoei ⬇️

scientific article

Inducible APOBEC3G-Vif double stable cell line as a high-throughput screening platform to identify antiviral compounds

scientific article

Inhibition of cysteine proteases by peptides containing aziridine-2,3-dicarboxylic acid building blocks

scientific article published on 01 January 1999

Inhibition of the Cysteine Protease Human Cathepsin L by Triazine Nitriles: Amide⋅⋅⋅Heteroarene π-Stacking Interactions and Chalcogen Bonding in the S3 Pocket

scientific article published on 19 December 2016

Inhibitors of cysteine proteases

scientific article

Mechanistic study of the reaction of thiol-containing enzymes with alpha,beta-unsaturated carbonyl substrates by computation and chemoassays

scientific article published in June 2010

Michael acceptor based antiplasmodial and antitrypanosomal cysteine protease inhibitors with unusual amino acids

scientific article published in March 2010

Natural products as inhibitors of recombinant cathepsin L of Leishmania mexicana

scientific article published on 01 June 2015

New Peptidic Cysteine Protease Inhibitors Derived from the Electrophilic α-Amino Acid Aziridine-2,3-dicarboxylic Acid

scientific article published on 01 February 1999

New cis-Configured Aziridine-2-carboxylates as Aspartic Acid Protease Inhibitors

scientific article published on 01 January 2011

New non-peptidic Inhibitors of Papain Derived from Etacrynic Acid

scientific article published on 01 July 2005

New tetromycin derivatives with anti-trypanosomal and protease inhibitory activities. ⬇️

scientific article

Non-peptidic inhibitors of cysteine proteases.

scientific article

Nonpeptidic vinyl and allyl phosphonates as falcipain-2 inhibitors

scientific article published on July 2008

Novel 2H-isoquinolin-3-ones as antiplasmodial falcipain-2 inhibitors.

scientific article published on 12 August 2009

Novel dengue virus NS2B/NS3 protease inhibitors

scientific article

Novel peptidomimetics containing a vinyl ester moiety as highly potent and selective falcipain-2 inhibitors.

scientific article published on April 2009

On the origin of the stabilization of the zwitterionic resting state of cysteine proteases: a theoretical study

scientific article published on 17 June 2008

On-bead screening of a combinatorial fumaric acid derived peptide library yields antiplasmodial cysteine protease inhibitors with unusual peptide sequences

scientific article published in September 2009

Optimization of peptidomimetic boronates bearing a P3 bicyclic scaffold as proteasome inhibitors

scientific article

Optimization of triazine nitriles as rhodesain inhibitors: structure-activity relationships, bioisosteric imidazopyridine nitriles, and X-ray crystal structure analysis with human cathepsin L

scientific article

Origin of the reactivity differences of substituted aziridines: CN vs CC bond breakages

scientific article published in August 2009

Peptidomimetics containing a vinyl ketone warhead as falcipain-2 inhibitors

scientific article published on 03 March 2011

Potent and Selective Inhibition of Cysteine Proteases fromPlasmodium falciparumandTrypanosoma brucei

scientific article published on 25 November 2010

Prospective Evaluation of Free Energy Calculations for the Prioritization of Cathepsin L Inhibitors.

scientific article published on 13 March 2017

Protocol for rational design of covalently interacting inhibitors

scientific article

Quantitative detection of C-deuterated drugs by CARS microscopy and Raman microspectroscopy

scientific article published on 25 July 2011

Quantum Chemical-Based Protocol for the Rational Design of Covalent Inhibitors.

scientific article

Rational Design of Aziridine-Containing Cysteine Protease Inhibitors with Improved Potency: Studies on Inhibition Mechanism

scientific article published on 01 September 2006

Rational design of improved aziridine-based inhibitors of cysteine proteases

scientific article published on April 2009

Reactivity differences between α,β-unsaturated carbonyls and hydrazones investigated by experimental and theoretical electron density and electron localizability analyses

scientific article published on 22 July 2011

Ruthenium(ii) and palladium(ii) homo- and heterobimetallic complexes: synthesis, crystal structures, theoretical calculations and biological studies

scientific article published on 16 October 2019

Screening of Protease Inhibitors as Antiplasmodial Agents. Part I: Aziridines and Epoxides

scientific article published on 01 August 2007

Screening of electrophilic compounds yields an aziridinyl peptide as new active-site directed SARS-CoV main protease inhibitor

scientific article

Selected cytotoxic gold compounds cause significant inhibition of 20S proteasome catalytic activities

scientific article published on 11 August 2014

Selected gold compounds cause pronounced inhibition of Falcipain 2 and effectively block P. falciparum growth in vitro

scientific article published on 10 September 2011

Synthesis and antiplasmodial activity of a cysteine protease-inhibiting biotinylated aziridine-2,3-dicarboxylate

scientific article

Synthesis and biological evaluation of novel peptidomimetics as rhodesain inhibitors

scientific article published on 16 November 2015

Synthesis and biological evaluation of papain-family cathepsin L-like cysteine protease inhibitors containing a 1,4-benzodiazepine scaffold as antiprotozoal agents

scientific article

Synthesis and evaluation of non-peptidic cysteine protease inhibitors of P. falciparum derived from etacrynic acid

scientific article

Synthesis and molecular modeling studies of derivatives of a highly potent peptidomimetic vinyl ester as falcipain-2 inhibitors.

scientific article

Synthesis of C3/C1-Substituted Tetrahydroisoquinolines.

scientific article published on 14 August 2015

Synthesis of novel peptidomimetics as inhibitors of protozoan cysteine proteases falcipain-2 and rhodesain

scientific article published on 14 April 2010

Taspase1: a 'misunderstood' protease with translational cancer relevance.

scientific article

Tetracycline-inducible expression of individual secreted aspartic proteases in Candida albicans allows isoenzyme-specific inhibitor screening

scientific article published on 22 October 2007

The Importance of the Active Site Histidine for the Activity of Epoxide- or Aziridine-Based Inhibitors of Cysteine Proteases

scientific article published on 01 January 2007

The significance of ionic bonding in sulfur dioxide: bond orders from X-ray diffraction data

scientific article

Theoretical studies about the influence of different ring substituents on the nucleophilic ring opening of three-membered heterocycles and possible implications for the mechanisms of cysteine protease inhibitors

scientific article published in January 2005

Thiirancarboxamides as inhibitors of papain

scientific article published in February 2004

Tuning and predicting biological affinity: aryl nitriles as cysteine protease inhibitors

scientific article published on 16 February 2012

aziridinyl peptides as inhibitors of cysteine proteases: Effect of a free carboxylic acid function on inhibition

scientific article published on 01 June 2000

List of works by Tanja Schirmeister

A comparative study on the experimentally derived electron densities of three protease inhibitor model compounds

A new lead for nonpeptidic active-site-directed inhibitors of the severe acute respiratory syndrome coronavirus main protease discovered by a combination of screening and docking methods

Allicin and derivates are cysteine protease inhibitors with antiparasitic activity

Anti-protease and Immunomodulatory Activities of Bacteria Associated with Caribbean Sponges

Anti-trypanosomal activities and structural chemical properties of selected compound classes

Antioxidant and anti-protease activities of diazepinomicin from the sponge-associated Micromonospora strain RV115

Asymmetric Disulfanylbenzamides as Irreversible and Selective Inhibitors of Staphylococcus aureus Sortase A

Atomistic insights into the inhibition of cysteine proteases: first QM/MM calculations clarifying the regiospecificity and the inhibition potency of epoxide- and aziridine-based inhibitors

Atomistic insights into the inhibition of cysteine proteases: first QM/MM calculations clarifying the stereoselectivity of epoxide-based inhibitors

Aziridide-Based Inhibitors of Cathepsin L: Synthesis, Inhibition Activity, and Docking Studies

Aziridine-2,3-dicarboxylate inhibitors targeting the major cysteine protease of Trypanosoma brucei as lead trypanocidal agents

Aziridine-2,3-dicarboxylate-based cysteine cathepsin inhibitors induce cell death in Leishmania major associated with accumulation of debris in autophagy-related lysosome-like vacuoles.

Aziridine-2,3-dicarboxylates, peptidomimetic cysteine protease inhibitors with antileishmanial activity

Benchmark Study for the Cysteine-Histidine Proton Transfer Reaction in a Protein Environment: Gas Phase, COSMO, QM/MM Approaches.

Biochemistry and medicinal chemistry of the dengue virus protease

Bis-acridines as lead antiparasitic agents: structure-activity analysis of a discrete compound library in vitro

Bistacrine derivatives as new potent antimalarials

Bistacrines as potential antitrypanosomal agents.

Blocking effect of a biotinylated protease inhibitor on the egress of Plasmodium falciparum merozoites from infected red blood cells

Cathepsin B in antigen-presenting cells controls mediators of the Th1 immune response during Leishmania major infection

Challenging Problems in Charge Density Determination: Polar Bonds and Influence of the Environment

Cis-Configured aziridines are new pseudo-irreversible dual-mode inhibitors of Candida albicans secreted aspartic protease 2.

Comparison of the separation of aziridine isomers applying heptakis(2,3-di-O-methyl-6-sulfato)beta-CD and heptakis(2,3-di-O-acetyl-6-sulfato)beta-CD in aqueous and nonaqueous systems

Constrained peptidomimetics as antiplasmodial falcipain-2 inhibitors

Cysteine Proteases and Their Inhibitors

Cytotoxicity of Endoperoxides from the Caribbean Sponge Plakortis halichondrioides towards Sensitive and Multidrug-Resistant Leukemia Cells: Acids vs. Esters Activity Evaluation.

Development and validation of a separation method for the diastereomers and enantiomers of aziridine-type protease inhibitors

Development of Novel Peptidomimetics Containing a Vinyl Sulfone Moiety as Proteasome Inhibitors

Development of a New Antileishmanial Aziridine-2,3-Dicarboxylate-Based Inhibitor with High Selectivity for Parasite Cysteine Proteases

Development of antitrypanosomal and antiplasmodial nonpeptidic cysteine protease inhibitors based on N-protected-guanidino-furan and -pyrrole building blocks

Development of novel 1,4-benzodiazepine-based Michael acceptors as antitrypanosomal agents

Development of novel dipeptide-like rhodesain inhibitors containing the 3-bromoisoxazoline warhead in a constrained conformation.

Development of novel selective peptidomimetics containing a boronic acid moiety, targeting the 20S proteasome as anticancer agents

Development of peptidomimetic boronates as proteasome inhibitors

Development of peptidomimetics with a vinyl sulfone warhead as irreversible falcipain-2 inhibitors.

Development of rhodesain inhibitors with a 3-bromoisoxazoline warhead

Dipeptidyl Enoates As Potent Rhodesain Inhibitors That Display a Dual Mode of Action

Dipeptidyl Nitroalkenes as Potent Reversible Inhibitors of Cysteine Proteases Rhodesain and Cruzain.

Effect of electron-withdrawing substituents on the epoxide ring: an experimental and theoretical electron density analysis of a series of epoxide derivatives

Effect of protease inhibitors on exflagellation in Plasmodium falciparum

Electrostatic complementarity in pseudoreceptor modeling based on drug molecule crystal structures: the case of loxistatin acid (E64c)

Erfolgreiches Konzept: Proteasen als Zielstrukturen für Antiinfektiva. Neue Angriffspunkte in der Infektionstherapie

Evaluation of dipeptide nitriles as inhibitors of rhodesain, a major cysteine protease of Trypanosoma brucei

Evidence for substrate binding-induced zwitterion formation in the catalytic Cys-His dyad of the SARS-CoV main protease

Flavonoids as noncompetitive inhibitors of Dengue virus NS2B-NS3 protease: inhibition kinetics and docking studies

Fluorine Scan of Inhibitors of the Cysteine Protease Human Cathepsin L: Dipolar and Quadrupolar Effects in the π-Stacking of Fluorinated Phenyl Rings on Peptide Amide Bonds

Fly versus man: evolutionary impairment of nucleolar targeting affects the degradome of Drosophila's Taspase1.

GNPS-guided discovery of xylacremolide C and D, evaluation of their putative biosynthetic origin and bioactivity studies of xylacremolide A and B

Gold compounds as cysteine protease inhibitors: perspectives for pharmaceutical application as antiparasitic agents

Identification of a new series of amides as non-covalent proteasome inhibitors.

Identification of a potential allosteric site of Golgi α-mannosidase II using computer-aided drug design

Identification of noncovalent proteasome inhibitors with high selectivity for chymotrypsin-like activity by a multistep structure-based virtual screening.

Identification of plakortide E from the Caribbean sponge Plakortis halichondroides as a trypanocidal protease inhibitor using bioactivity-guided fractionation

Identification of the protease inhibitor miraziridine A in the Red sea sponge Theonella swinhoei ⬇️

Inducible APOBEC3G-Vif double stable cell line as a high-throughput screening platform to identify antiviral compounds

Inhibition of cysteine proteases by peptides containing aziridine-2,3-dicarboxylic acid building blocks

Inhibition of the Cysteine Protease Human Cathepsin L by Triazine Nitriles: Amide⋅⋅⋅Heteroarene π-Stacking Interactions and Chalcogen Bonding in the S3 Pocket

Inhibitors of cysteine proteases

Mechanistic study of the reaction of thiol-containing enzymes with alpha,beta-unsaturated carbonyl substrates by computation and chemoassays

Michael acceptor based antiplasmodial and antitrypanosomal cysteine protease inhibitors with unusual amino acids

Natural products as inhibitors of recombinant cathepsin L of Leishmania mexicana

New Peptidic Cysteine Protease Inhibitors Derived from the Electrophilic α-Amino Acid Aziridine-2,3-dicarboxylic Acid

New cis-Configured Aziridine-2-carboxylates as Aspartic Acid Protease Inhibitors

New non-peptidic Inhibitors of Papain Derived from Etacrynic Acid

New tetromycin derivatives with anti-trypanosomal and protease inhibitory activities. ⬇️

Non-peptidic inhibitors of cysteine proteases.

Nonpeptidic vinyl and allyl phosphonates as falcipain-2 inhibitors

Novel 2H-isoquinolin-3-ones as antiplasmodial falcipain-2 inhibitors.

Novel dengue virus NS2B/NS3 protease inhibitors

Novel peptidomimetics containing a vinyl ester moiety as highly potent and selective falcipain-2 inhibitors.

On the origin of the stabilization of the zwitterionic resting state of cysteine proteases: a theoretical study

On-bead screening of a combinatorial fumaric acid derived peptide library yields antiplasmodial cysteine protease inhibitors with unusual peptide sequences

Optimization of peptidomimetic boronates bearing a P3 bicyclic scaffold as proteasome inhibitors

Optimization of triazine nitriles as rhodesain inhibitors: structure-activity relationships, bioisosteric imidazopyridine nitriles, and X-ray crystal structure analysis with human cathepsin L

Origin of the reactivity differences of substituted aziridines: CN vs CC bond breakages

Peptidomimetics containing a vinyl ketone warhead as falcipain-2 inhibitors

Potent and Selective Inhibition of Cysteine Proteases fromPlasmodium falciparumandTrypanosoma brucei

Prospective Evaluation of Free Energy Calculations for the Prioritization of Cathepsin L Inhibitors.

Protocol for rational design of covalently interacting inhibitors