A. Brancale

发表

Molecular modelling studies on Arylthioindoles as potent inhibitors of tubulin polymerization.

A. Coluccia, Davide Sabbadin, A. Brancale, 2011, European journal of medicinal chemistry.

The application of phosphoramidate protide technology to acyclovir confers anti-HIV inhibition.

A. Brancale, L. Margolis, J. Balzarini, 2009, Journal of medicinal chemistry.

Molecular dynamics at the receptor level of immunodominant myelin basic protein epitope 87-99 implicated in multiple sclerosis and its antagonists altered peptide ligands: triggering of immune response.

Theodore V. Tselios, J. Platts, A. Brancale, 2007, Journal of molecular graphics & modelling.

De novo computer-aided design of novel antiviral agents.

A. Coluccia, A. Brancale, R. Silvestri, 2012, Drug discovery today. Technologies.

Enzymatic activity of albumin shown by coelenterazine chemiluminescence.

A. Campbell, A. Brancale, C. D. Cox, 2012, Luminescence : the journal of biological and chemical luminescence.

The repositioning of epigenetic probes/inhibitors identifies new anti-schistosomal lead compounds and chemotherapeutic targets

Kathrin K. Geyer, A. Brancale, K. Hoffmann, 2019, PLoS neglected tropical diseases.

The repositioning of epigenetic probes/inhibitors identifies new anti-schistosomal lead compounds and chemotherapeutic targets

Kathrin K. Geyer, A. Brancale, K. Hoffmann, 2019, bioRxiv.

In silico identification, design and synthesis of novel piperazine-based antiviral agents targeting the hepatitis C virus helicase.

A. Brancale, J. Neyts, P. Leyssen, 2017, European journal of medicinal chemistry.

Computer-aided identification, synthesis and evaluation of substituted thienopyrimidines as novel inhibitors of HCV replication.

A. Brancale, J. Neyts, P. Leyssen, 2016, European journal of medicinal chemistry.

Impairment of cocaine-mediated behaviours in mice by clinically relevant Ras-ERK inhibitors

R. Spanagel, A. Brancale, S. Fasano, 2016, eLife.

Antiviral Chemistry & Chemotherapy's Current Antiviral Agents FactFile 2006 (1st edition): The RNA Viruses with DNA Intermediates (Retroviruses)

A. Brancale, E. Clercq, H. Field, 2006 .

Virtual screening-driven identification of human carbonic anhydrase inhibitors incorporating an original, new pharmacophore.

C. Supuran, A. Brancale, A. Dessì, 2011, Bioorganic & medicinal chemistry letters.

Discovery and optimization of a series of 2-aryl-4-amino-5-(3',4',5'-trimethoxybenzoyl)thiazoles as novel anticancer agents.

María Kimatrai Salvador, A. Brancale, G. Basso, 2012, Journal of medicinal chemistry.

The role of substrate specificity and metal binding in defining the activity and structure of an intracellular subtilisin

A. Brancale, K. Wilson, D. D. Jones, 2012, FEBS open bio.

Design, synthesis, in vitro and in vivo biological evaluation of 2-amino-3-aroylbenzo[b]furan derivatives as highly potent tubulin polymerization inhibitors.

A. Brancale, G. Viola, Roberta Bortolozzi, 2020, European journal of medicinal chemistry.

Enhanced efficacy of endonuclease inhibitor baloxavir acid against orthobunyaviruses when used in combination with ribavirin.

S. Günther, A. Brancale, J. Neyts, 2020, The Journal of antimicrobial chemotherapy.

Comparative modeling of 25-hydroxycholesterol-7α-hydroxylase (CYP7B1): ligand binding and analysis of hereditary spastic paraplegia type 5 CYP7B1 mutations

A. Brancale, C. Simons, A. Siam, 2012, Journal of Molecular Modeling.

Concise synthesis and biological evaluation of 2-Aryl-3-Anilinobenzo[b]thiophene derivatives as potent apoptosis-inducing agents.

A. Brancale, P. Pinton, G. Viola, 2021, Bioorganic chemistry.

Quercetin derivatives as novel antihypertensive agents: Synthesis and physiological characterization.

A. Brancale, F. Puoci, C. Saturnino, 2016, European journal of pharmaceutical sciences : official journal of the European Federation for Pharmaceutical Sciences.

Geneticin shows selective antiviral activity against SARS-CoV-2 by targeting programmed -1 ribosomal frameshifting

A. Brancale, C. Bertelli, V. Cagno, 2022 .

The discovery of purine-based agents targeting triple-negative breast cancer and the αB-crystallin/VEGF protein–protein interaction

A. Brancale, A. Westwell, Wen Jiang, 2018, Medicinal Chemistry Research.

Anti-schistosomal activities of quinoxaline-containing compounds: From hit identification to lead optimisation

A. Brancale, C. Caffrey, A. Jones, 2021, European journal of medicinal chemistry.

Schistosoma mansoni lysine specific demethylase 1 (SmLSD1) is a druggable target involved in parasite survival, oviposition and stem cell proliferation

H. Rienhoff, A. Brancale, P. Cole, 2020, bioRxiv.

Identification of novel 2-(1H-indol-1-yl)-benzohydrazides CXCR4 ligands impairing breast cancer growth and motility.

C. Giordano, I. Barone, S. Catalano, 2016, Future medicinal chemistry.

Broad‐spectrum non‐nucleoside inhibitors for caliciviruses

A. Brancale, J. Mackenzie, P. White, 2017, Antiviral research.

A new series of bicalutamide, enzalutamide and enobosarm derivatives carrying pentafluorosulfanyl (SF5) and pentafluoroethyl (C2F5) substituents: Improved antiproliferative agents against prostate cancer.

A. Brancale, A. Westwell, C. Mcguigan, 2019, European journal of medicinal chemistry.

Synthesis and Biological Evaluation of Highly Active 7-Anilino Triazolopyrimidines as Potent Antimicrotubule Agents

B. Cacciari, A. Brancale, G. Viola, 2022, Pharmaceutics.

Structure‐activity relationship study of itraconazole, a broad‐range inhibitor of picornavirus replication that targets oxysterol‐binding protein (OSBP)

Jun O. Liu, A. Brancale, F. V. van Kuppeveld, 2018, Antiviral research.

Identification of SARS-CoV-2 inhibitors targeting Mpro and PLpro using in-cell-protease assay

K. Murakami, A. Brancale, M. Narwal, 2022, Communications Biology.

Virtual screening, SAR, and discovery of 5‐(indole‐3‐yl)‐2‐[(2‐nitrophenyl)amino] [1,3,4]‐oxadiazole as a novel Bcl‐2 inhibitor

A. Brancale, A. Westwell, A. Jones, 2017, Chemical biology & drug design.

Indolylarylsulfones bearing natural and unnatural amino acids. Discovery of potent inhibitors of HIV-1 non-nucleoside wild type and resistant mutant strains reverse transcriptase and coxsackie B4 virus.

E. Novellino, A. Lavecchia, A. Coluccia, 2009, Journal of medicinal chemistry.

Synthesis and biological evaluation of novel flexible nucleoside analogues that inhibit flavivirus replication in vitro

B. Coutard, A. Brancale, E. Decroly, 2020, Bioorganic & Medicinal Chemistry.

Synthesis and Antitumor Molecular Mechanism of Agents Based on Amino 2‐(3′,4′,5′‐Trimethoxybenzoyl)benzo[b]furan: Inhibition of Tubulin and Induction of Apoptosis

A. Brancale, O. Cruz-López, J. Balzarini, 2011, ChemMedChem.

CHIKV strains Brazil (wt) and Ross (lab-adapted) differ with regard to cell host range and antiviral sensitivity and show CPE in human glioblastoma cell lines U138 and U251

A. Brancale, J. Bugert, M. Bassetto, 2022, Virus Genes.

Toward highly potent cancer agents by modulating the C-2 group of the arylthioindole class of tubulin polymerization inhibitors.

Y. Ni, E. Novellino, B. Maresca, 2013, Journal of medicinal chemistry.

Design, synthesis and structure-activity relationship of 2-(3',4',5'-trimethoxybenzoyl)-benzo[b]furan derivatives as a novel class of inhibitors of tubulin polymerization.

A. Brancale, O. Cruz-López, J. Balzarini, 2009, Bioorganic & medicinal chemistry.

Synthesis and biological evaluation of 2-amino-3-(3',4',5'-trimethoxybenzoyl)-6-substituted-4,5,6,7-tetrahydrothieno[2,3-c]pyridine derivatives as antimitotic agents and inhibitors of tubulin polymerization.

A. Brancale, O. Cruz-López, J. Balzarini, 2008, Bioorganic & medicinal chemistry letters.

Networks of enzymatically oxidized membrane lipids support calcium-dependent coagulation factor binding to maintain hemostasis

Christopher P. Thomas, P. Taylor, D. Farewell, 2017, Science Signaling.

Novel styryl-indoles as small molecule inhibitors of 25-hydroxyvitamin D-24-hydroxylase (CYP24A1): Synthesis and biological evaluation.

H. DeLuca, A. Brancale, C. Simons, 2014, European journal of medicinal chemistry.

Rational design of highly potent broad-spectrum enterovirus inhibitors targeting the nonstructural protein 2C

A. Brancale, J. Neyts, F. V. van Kuppeveld, 2020, PLoS biology.

Evaluation of the Structure-Activity Relationship of Microtubule-Targeting 1,2,4-Triazolo[1,5-a]pyrimidines Identifies New Candidates for Neurodegenerative Tauopathies.

J. Trojanowski, V. Lee, A. Brancale, 2021, Journal of medicinal chemistry.

Design, synthesis and biological evaluation of 3,5-disubstituted 2-amino thiophene derivatives as a novel class of antitumor agents.

María Kimatrai Salvador, A. Brancale, G. Basso, 2014, Bioorganic & medicinal chemistry.

Concise synthesis and biological evaluation of 2-Aroyl-5-amino benzo[b]thiophene derivatives as a novel class of potent antimitotic agents.

A. Brancale, G. Basso, Su-zhan Zhang, 2013, Journal of medicinal chemistry.

Synthesis and evaluation of 1,5-disubstituted tetrazoles as rigid analogues of combretastatin A-4 with potent antiproliferative and antitumor activity.

María Kimatrai Salvador, A. Brancale, G. Basso, 2012, Journal of medicinal chemistry.

One-pot synthesis and biological evaluation of 2-pyrrolidinyl-4-amino-5-(3',4',5'-trimethoxybenzoyl)thiazole: a unique, highly active antimicrotubule agent.

A. Brancale, G. Basso, Su-zhan Zhang, 2011, European journal of medicinal chemistry.

Synthesis and antitumor activity of 1,5-disubstituted 1,2,4-triazoles as cis-restricted combretastatin analogues.

A. Brancale, G. Basso, G. Viola, 2010, Journal of medicinal chemistry.

Synthesis and evaluation of 3-(benzylthio)-5-(1H-indol-3-yl)-1,2,4-triazol-4-amines as Bcl-2 inhibitory anticancer agents.

A. Brancale, A. Westwell, A. Jones, 2013, Bioorganic & medicinal chemistry letters.

Kinase-independent phosphoramidate S1P1 receptor agonist benzyl ether derivatives.

A. Brancale, C. Mcguigan, F. Pertusati, 2017, Bioorganic & medicinal chemistry letters.

Synthesis and CYP24A1 inhibitory activity of (E)-2-(2-substituted benzylidene)- and 2-(2-substituted benzyl)-6-methoxy-tetralones.

A. Brancale, Glenville Jones, C. Simons, 2010, European journal of medicinal chemistry.

Synthesis and CYP26A1 inhibitory activity of novel methyl 3-[4-(arylamino)phenyl]-3-(azole)-2,2-dimethylpropanoates.

A. Brancale, C. Simons, J. Armstrong, 2012, Bioorganic & medicinal chemistry.

Characterizing the original anti‐C5 function‐blocking antibody, BB5.1, for species specificity, mode of action and interactions with C5

B. Stockinger, A. Brancale, B. Morgan, 2020, Immunology.

Convergent synthesis and biological evaluation of 2-amino-4-(3',4',5'-trimethoxyphenyl)-5-aryl thiazoles as microtubule targeting agents.

A. Brancale, G. Basso, G. Viola, 2011, Journal of medicinal chemistry.

1 Design , Synthesis , in Vitro and in Vivo Biological Evaluation of 2-Amino-3-Aroylbenzo [ b ] furan Derivatives as Highly Potent Tubulin Polymerization Inhibitors

A. Brancale, G. Viola, Roberta Bortolozzi, 2022 .

Design and Synthesis of Potent in Vitro and in Vivo Anticancer Agents Based on 1-(3′,4′,5′-Trimethoxyphenyl)-2-Aryl-1H-Imidazole

A. Brancale, G. Basso, G. Viola, 2016, Scientific Reports.

Identification of 6-(piperazin-1-yl)-1,3,5-triazine as a chemical scaffold with broad anti-schistosomal activities

A. Brancale, K. Hoffmann, G. Padalino, 2020, Wellcome open research.

Structure-based Virtual Screening to Get New Scaffold Inhibitors of the Ser/Thr Protein Kinase PknB from Mycobacterium tuberculosis

A. Coluccia, A. Brancale, R. Silvestri, 2016 .

Discovery of Novel 2-Aniline-1,4-naphthoquinones as Potential New Drug Treatment for Leber's Hereditary Optic Neuropathy (LHON).

M. Votruba, A. Brancale, C. Heard, 2020, Journal of medicinal chemistry.

Computational Studies towards the Identification of Novel Rhodopsin-Binding Compounds as Chemical Chaperones for Misfolded Opsins

A. Brancale, M. Schepelmann, M. Różanowska, 2020, Molecules.

Exploring the structural requirements for inhibition of the ubiquitin E3 ligase breast cancer associated protein 2 (BCA2) as a treatment for breast cancer.

A. Brancale, A. Westwell, A. Burger, 2010, Journal of medicinal chemistry.

Identification of Small Molecular Chaperones Binding P23H Mutant Opsin through an In Silico Structure-Based Approach

A. Brancale, M. Mori, M. Bassetto, 2022, J. Chem. Inf. Model..

Ligand-based rational design, synthesis and evaluation of novel potential chemical chaperones for opsin.

A. Brancale, M. Schepelmann, M. Różanowska, 2021, European journal of medicinal chemistry.

A facile synthesis of diaryl pyrroles led to the discovery of potent colchicine site antimitotic agents.

María Kimatrai Salvador, A. Brancale, G. Viola, 2021, European journal of medicinal chemistry.

Design, synthesis and biological evaluation of novel vicinal diaryl-substituted 1H-Pyrazole analogues of combretastatin A-4 as highly potent tubulin polymerization inhibitors.

María Kimatrai Salvador, A. Brancale, G. Viola, 2019, European journal of medicinal chemistry.

Ligand-based discovery of a novel GATA2 inhibitor targeting acute myeloid leukemia cells

A. Brancale, N. Rodrigues, S. Ferla, 2022, Frontiers in Drug Discovery.

Synthesis and Biological Evaluation of Purine 2′‐Fluoro‐2′‐deoxyriboside ProTides as Anti‐influenza Virus Agents

L. Naesens, A. Brancale, J. Balzarini, 2013, ChemMedChem.

Synthesis and biological evaluation of 2-substituted-4-(3',4',5'-trimethoxyphenyl)-5-aryl thiazoles as anticancer agents.

María Kimatrai Salvador, A. Brancale, G. Basso, 2012, Bioorganic & medicinal chemistry.

Novel symmetrical phenylenediamines as potential anti-hepatitis C virus agents

A. Brancale, J. Neyts, P. Leyssen, 2015, Antiviral chemistry & chemotherapy.

Rational design of novel nucleoside analogues reveals potent antiviral agents for EV71.

A. Brancale, J. Neyts, D. Jochmans, 2022, European journal of medicinal chemistry.

Bicyclic nucleoside inhibitors of Varicella-Zoster Virus (VZV): the effect of a terminal halogen substitution in the side-chain.

E. De Clercq, A. Brancale, J. Balzarini, 2000, Bioorganic & medicinal chemistry letters.

Geneticin shows selective antiviral activity against SARS-CoV-2 by interfering with programmed −1 ribosomal frameshifting

A. Brancale, C. Bertelli, V. Cagno, 2022, Antiviral Research.

Targeting the Viral Polymerase of Diarrhea-Causing Viruses as a Strategy to Develop a Single Broad-Spectrum Antiviral Therapy

A. Brancale, J. Neyts, M. Bassetto, 2019, Viruses.

In silico structure-based design and synthesis of novel anti-RSV compounds.

A. Brancale, F. V. van Kuppeveld, C. D. de Haan, 2015, Antiviral research.

Design, synthesis and evaluation of a novel double pro-drug: INX-08189. A new clinical candidate for hepatitis C virus.

E. Gorovits, A. Brancale, A. Kolykhalov, 2010, Bioorganic & medicinal chemistry letters.

ProTides of BVdU as potential anticancer agents upon efficient intracellular delivery of their activated metabolites

A. Brancale, A. Westwell, J. Balzarini, 2016, Bioorganic & medicinal chemistry letters.

1 Synthesis , Antimitotic and Antivascular Activity of 1-( 3 ’ , 4 ’ , 5 ’-Trimethoxybenzoyl )-3-Arylamino-5-Amino-1 , 2 , 4-Triazoles

María Kimatrai Salvador, A. Brancale, P. Baraldi, 2015 .

Synthesis and evaluation of 5-(indol-3-yl)- N -aryl- 1,3,4-oxadiazol-2-amines as Bcl-2 inhibitory anticancer agents

A. Brancale, A. Westwell, A. Jones, 2017 .

Structural Investigations on Novel Non-Nucleoside Inhibitors of Human Norovirus Polymerase

A. Brancale, R. Silvestri, J. Neyts, 2022, Viruses.

Structure–Activity Relationship Studies on Novel Antiviral Agents for Norovirus Infections

A. Brancale, J. Neyts, N. Santos-Ferreira, 2021, Microorganisms.

Arylsulfone-based HIV-1 non-nucleoside reverse transcriptase inhibitors.

A. Coluccia, A. Brancale, R. Silvestri, 2013, Future medicinal chemistry.

New arylthioindoles: potent inhibitors of tubulin polymerization. 2. Structure-activity relationships and molecular modeling studies.

Andrea Brancale, Gabriela Chiosis, Ernest Hamel, 2006, Journal of medicinal chemistry.

Arylthioindoles, potent inhibitors of tubulin polymerization.

Andrea Brancale, Ernest Hamel, Antonio Coluccia, 2004, Journal of medicinal chemistry.

Novel retinoic acid 4-hydroxylase (CYP26) inhibitors based on a 3-(1H-imidazol- and triazol-1-yl)-2,2-dimethyl-3-(4-(phenylamino)phenyl)propyl scaffold.

A. Brancale, C. Simons, J. Armstrong, 2012, Bioorganic & medicinal chemistry.

Synthesis and biological evaluation of 3-(1H-imidazol- and triazol-1-yl)-2,2-dimethyl-3-[4-(naphthalen-2-ylamino)phenyl]propyl derivatives as small molecule inhibitors of retinoic acid 4-hydroxylase (CYP26).

A. Brancale, C. Simons, J. Armstrong, 2011, Journal of medicinal chemistry.

Design and synthesis of substituted imidazole and triazole N-phenylbenzo[d]oxazolamine inhibitors of retinoic acid metabolizing enzyme CYP26

A. Brancale, C. Simons, M. Coogan, 2009, Journal of enzyme inhibition and medicinal chemistry.

Novel azolyl-(phenylmethyl)]aryl/heteroarylamines: potent CYP26 inhibitors and enhancers of all-trans retinoic acid activity in neuroblastoma cells.

A. Brancale, C. Simons, J. Armstrong, 2008, Bioorganic & medicinal chemistry.

Homology Model of Human Retinoic Acid Metabolising Enzyme Cytochrome P450 26A1 (CYP26A1): Active Site Architecture and Ligand Binding

S. Yee, A. Brancale, C. Simons, 2006, Journal of enzyme inhibition and medicinal chemistry.

New avenues for therapy in mitochondrial optic neuropathies

B. Newland, M. Votruba, A. Brancale, 2021, Therapeutic advances in rare disease.

Synthesis and Biological Evaluation of New Antitubulin Agents Containing 2-(3′,4′,5′-trimethoxyanilino)-3,6-disubstituted-4,5,6,7-tetrahydrothieno[2,3-c]pyridine Scaffold

R. Gambari, A. Finotti, B. Cacciari, 2020, Molecules.

Microwave-assisted organic synthesis of nucleoside ProTide analogues

A. Brancale, Elisa Azzali, G. Costantino, 2019, RSC advances.

Structural biology in antiviral drug discovery

A. Coluccia, A. Brancale, A. Massarotti, 2016, Current Opinion in Pharmacology.

Synthesis and biological evaluation of 2- and 3-aminobenzo[b]thiophene derivatives as antimitotic agents and inhibitors of tubulin polymerization.

Jan Balzarini, John A Hadfield, Andrea Brancale, 2007, Journal of medicinal chemistry.

Monoamine Oxidase (MAO-N) Biocatalyzed Synthesis of Indoles from Indolines Prepared via Photocatalytic Cyclization/Arylative Dearomatization

A. Brancale, N. Turner, Domiziana Masci, 2020, ACS Catalysis.

New arylthioindoles and related bioisosteres at the sulfur bridging group. 4. Synthesis, tubulin polymerization, cell growth inhibition, and molecular modeling studies.

E. Novellino, B. Maresca, A. Coluccia, 2009, Journal of medicinal chemistry.

Synthesis and biological evaluation of 2-(3',4',5'-trimethoxybenzoyl)-3-N,N-dimethylamino benzo[b]furan derivatives as inhibitors of tubulin polymerization.

R. Gambari, A. Brancale, O. Cruz-López, 2008, Bioorganic & medicinal chemistry.

Synthesis and biological evaluation of 1-methyl-2-(3',4',5'-trimethoxybenzoyl)-3-aminoindoles as a new class of antimitotic agents and tubulin inhibitors.

H. Hsieh, A. Brancale, O. Cruz-López, 2008, Journal of medicinal chemistry.

Indolylarylsulfones as HIV-1 non-nucleoside reverse transcriptase inhibitors: new cyclic substituents at indole-2-carboxamide.

E. Novellino, C. Pannecouque, A. Coluccia, 2011, Journal of medicinal chemistry.

Indole, a core nucleus for potent inhibitors of tubulin polymerization

Andrea Brancale, Romano Silvestri, A. Brancale, 2007, Medicinal research reviews.

Characterization of the Mode of Action of a Potent Dengue Virus Capsid Inhibitor

Chelsea M. Byrd, R. Bartenschlager, A. Brancale, 2014, Journal of Virology.

Arylthioindole inhibitors of tubulin polymerization. 3. Biological evaluation, structure-activity relationships and molecular modeling studies.

Anna Ivana Scovassi, Ettore Novellino, Andrea Brancale, 2007, Journal of medicinal chemistry.

Small molecule inhibitors of retinoic acid 4-hydroxylase (CYP26): synthesis and biological evaluation of imidazole methyl 3-(4-(aryl-2-ylamino)phenyl)propanoates.

A. Brancale, C. Simons, J. Armstrong, 2011, Journal of medicinal chemistry.

Design, synthesis, and biological evaluation of thiophene analogues of chalcones.

A. Brancale, O. Cruz-López, J. Balzarini, 2008, Bioorganic & medicinal chemistry.

Design, synthesis, and biological evaluation of 1-phenylpyrazolo[3,4-e]pyrrolo[3,4-g]indolizine-4,6(1H,5H)-diones as new glycogen synthase kinase-3β inhibitors.

E. Novellino, A. Coluccia, A. Brancale, 2013, Journal of medicinal chemistry.

Design and synthesis of 2-heterocyclyl-3-arylthio-1H-indoles as potent tubulin polymerization and cell growth inhibitors with improved metabolic stability.

Ettore Novellino, Andrea Brancale, Ilaria Granata, 2011, Journal of medicinal chemistry.

Specific recognition of the bicyclic pyrimidine nucleoside analogs, a new class of highly potent and selective inhibitors of varicella-zoster virus (VZV), by the VZV-encoded thymidine kinase.

E. De Clercq, L. Naesens, A. Brancale, 2002, Molecular pharmacology.

Potent and selective inhibition of varicella-zoster virus (VZV) by nucleoside analogues with an unusual bicyclic base.

E. De Clercq, A. Brancale, J. Balzarini, 1999, Journal of medicinal chemistry.

Furano Pyrimidines as Novel Potent and Selective Anti-VZV Agents

E. De Clercq, A. Brancale, O. Bidet, 2001, Antiviral chemistry & chemotherapy.

Synthesis and Biological Evaluation of 2-Methyl-4,5-Disubstituted Oxazoles as a Novel Class of Highly Potent Antitubulin Agents

María Kimatrai Salvador, A. Brancale, G. Basso, 2017, Scientific Reports.

New Indole Tubulin Assembly Inhibitors Cause Stable Arrest of Mitotic Progression, Enhanced Stimulation of Natural Killer Cell Cytotoxic Activity, and Repression of Hedgehog-Dependent Cancer.

E. Novellino, L. Di Marcotullio, C. Martini, 2015, Journal of medicinal chemistry.

New pyrrole derivatives with potent tubulin polymerization inhibiting activity as anticancer agents including hedgehog-dependent cancer.

Ettore Novellino, Andrea Brancale, Ruoli Bai, 2014, Journal of medicinal chemistry.

Novel potential anticancer naphthyl phosphoramidates of BVdU: separation of diastereoisomers and assignment of the absolute configuration of the phosphorus center.

M. Mason, A. Brancale, C. Mcguigan, 2006, Journal of medicinal chemistry.

Synthesis and biological evaluation of 2-(alkoxycarbonyl)-3-anilinobenzo[b]thiophenes and thieno[2,3-b]pyridines as new potent anticancer agents.

A. Brancale, G. Basso, G. Viola, 2013, Journal of medicinal chemistry.

Novel tetralone-derived retinoic acid metabolism blocking agents: synthesis and in vitro evaluation with liver microsomal and MCF-7 CYP26A1 cell assays.

R. Nicholson, S. Yee, A. Brancale, 2005, Journal of medicinal chemistry.

In vitro Topical Delivery of Chlorhexidine to the Cornea: Enhancement using Drug-Loaded Contact Lenses and β-Cyclodextrin Complexation, and the Importance of Simulating Tear Irrigation.

A. Quantock, M. Burton, A. Brancale, 2020, Molecular pharmaceutics.

Indolylarylsulfones carrying a heterocyclic tail as very potent and broad spectrum HIV-1 non-nucleoside reverse transcriptase inhibitors.

E. Novellino, A. Coluccia, A. Brancale, 2014, Journal of Medicinal Chemistry.

New indolylarylsulfones as highly potent and broad spectrum HIV-1 non-nucleoside reverse transcriptase inhibitors.

E. Novellino, B. Clotet, A. Coluccia, 2014, European journal of medicinal chemistry.

A putative bioactive conformation for the altered peptide ligand of myelin basic protein and inhibitor of experimental autoimmune encephalomyelitis [Arg91, Ala96] MBP87-99.

J. Platts, A. Brancale, S. Grdadolnik, 2006, Journal of molecular graphics & modelling.

Sulfonated cryogel scaffolds for focal delivery in ex-vivo brain tissue cultures.

Laura C. Andreae, B. Newland, W. Huttner, 2021, Biomaterials.

Evaluation of a Fluorescent Derivative of AMD3100 and its Interaction with the CXCR4 Chemokine Receptor

A. Brancale, S. Paisey, P. G. Edwards, 2011, Chembiochem : a European journal of chemical biology.

Design, synthesis and biological evaluation of 2-alkoxycarbonyl-3-anilinoindoles as a new class of potent inhibitors of tubulin polymerization.

A. Brancale, G. Viola, Roberta Bortolozzi, 2020, Bioorganic chemistry.

Advanced in silico Approaches in Antiviral Research

Nicola Zonta, Andrea Brancale, Antonio Coluccia, 2010, Antiviral chemistry & chemotherapy.

1 3-Aryl / Heteroaryl-5-Amino-1-( 3 ’ , 4 ’ , 5 ’-Trimethoxybenzoyl )-1 , 2 , 4-Triazoles as Antimicrotubule Agents . Design , Synthesis , Antiproliferative Activity and Inhibition of Tubulin Polymerization

A. Brancale, G. Viola, Roberta Bortolozzi, 2018 .

Rational modifications on a benzylidene-acrylohydrazide antiviral scaffold, synthesis and evaluation of bioactivity against Chikungunya virus.

E. Novellino, A. Brancale, L. Delang, 2018, European journal of medicinal chemistry.

Computer-aided identification, design and synthesis of a novel series of compounds with selective antiviral activity against chikungunya virus.

A. Coluccia, A. Brancale, R. Silvestri, 2013, Antiviral research.

The search for antivirals to treat alphavirus infections

A. Brancale, M. Bassetto, Marcella Bassetto, 2021, Annual Reports in Medicinal Chemistry.

Discovery of novel multi-target indole-based derivatives as potent and selective inhibitors of chikungunya virus replication.

A. Brancale, L. Delang, J. Neyts, 2017, Bioorganic & medicinal chemistry.

Antivirals in medical biodefense

A. Brancale, J. Bugert, M. Bassetto, 2020, Virus Genes.

Synthesis, antimitotic and antivascular activity of 1-(3',4',5'-trimethoxybenzoyl)-3-arylamino-5-amino-1,2,4-triazoles.

María Kimatrai Salvador, A. Brancale, G. Basso, 2014, Journal of medicinal chemistry.

Evaluation of Novel Phosphoramidate ProTides of the 2′-Fluoro Derivatives of a Potent Anti-Varicella Zoster Virus Bicyclic Nucleoside Analogue

A. Brancale, J. Balzarini, Marco Derudas, 2010, Antiviral chemistry & chemotherapy.

Design, synthesis, and anti-HIV activity of 2',3'-didehydro-2',3'-dideoxyuridine (d4U), 2',3'-dideoxyuridine (ddU) phosphoramidate 'ProTide' derivatives.

A. Brancale, J. Balzarini, C. Mcguigan, 2007, Bioorganic & medicinal chemistry letters.

Novel Nucleoside Analogues as Effective Antiviral Agents for Zika Virus Infections

A. Brancale, J. Bugert, M. Bassetto, 2020, Molecules.

Fluorescent bicyclic furo pyrimidine deoxynucleoside analogs as potent and selective inhibitors of VZV and potential future drugs for the treatment of chickenpox and shingles

A. Brancale, J. Balzarini, E. Clercq, 2000 .

Application of the phosphoramidate ProTide approach to the antiviral drug ribavirin

L. Naesens, A. Brancale, J. Neyts, 2008, Bioorganic & Medicinal Chemistry.

Synthesis of novel antimitotic agents based on 2-amino-3-aroyl-5-(hetero)arylethynyl thiophene derivatives.

Jan Balzarini, Andrea Brancale, Ernest Hamel, 2011, Bioorganic & Medicinal Chemistry Letters.

Base damage, local sequence context and TP53 mutation hotspots: a molecular dynamics study of benzo[a]pyrene induced DNA distortion and mutability

A. Brancale, S. Reed, G. Menzies, 2015, Nucleic acids research.

The Tubulin Colchicine Domain: a Molecular Modeling Perspective

Andrea Brancale, Alberto Massarotti, Antonio Coluccia, 2012, ChemMedChem.

2-Arylamino-4-amino-5-aroylthiazoles. "One-pot" synthesis and biological evaluation of a new class of inhibitors of tubulin polymerization.

A. Brancale, G. Basso, G. Viola, 2009, Journal of medicinal chemistry.

Design, Synthesis and Biological Investigation of 2-Anilino Triazolopyrimidines as Tubulin Polymerization Inhibitors with Anticancer Activities

A. Brancale, G. Viola, Roberta Bortolozzi, 2022, Pharmaceuticals.

N-METHYLPURINE DNA GLYCOSYLASE AND 8-OXOGUANINE DNA GLYCOSYLASE METABOLIZE THE ANTIVIRAL NUCLEOSIDE 2-BROMO-5,6-DICHLORO-1-(β-D-RIBOFURANOSYL)BENZIMIDAZOLE

G. Amidon, Xueqin Song, A. Brancale, 2006, Drug Metabolism and Disposition.

Synthesis and evaluation against hepatitis C virus of 7-deaza analogues of 2'-C-methyl-6-O-methyl guanosine nucleoside and L-Alanine ester phosphoramidates.

E. Gorovits, A. Brancale, A. Kolykhalov, 2013, Bioorganic & medicinal chemistry letters.

Suramin Inhibits Chikungunya Virus Replication by Interacting with Virions and Blocking the Early Steps of Infection

A. Brancale, M. V. van Hemert, J. Smit, 2020, Viruses.

University of Groningen Suramin Inhibits Chikungunya Virus Replication by Interacting with Virions and Blocking the Early Steps of Infection Albulescu,

A. Brancale, J. Smit, T. Hoornweg, 2020 .

Antiviral Chemistry & Chemotherapy's Current Antiviral Agents FactFile 2006 (1st Edition)

A. Brancale, M. Baba, R. Sidwell, 2006, Antiviral chemistry & chemotherapy.

Therapeutically targeting guanylate cyclase‐C: computational modeling of plecanatide, a uroguanylin analog

K. Shailubhai, A. Brancale, A. Ricci, 2017, Pharmacology research & perspectives.

Discovery of a novel HCV helicase inhibitor by a de novo drug design approach.

Dimitrios Vlachakis, Colin Berry, Andrea Brancale, 2008, Bioorganic & medicinal chemistry letters.

organic synthesis of nucleoside ProTide analogues †

A. Brancale, Elisa Azzali, C. Bordoni, 2019 .

Novel bicyclic furanopyrimidines with dual anti-VZV and -HCMV activity.

E. De Clercq, A. Brancale, J. Balzarini, 2003, Bioorganic & medicinal chemistry letters.

Synthesis and Anti-Varicella-Zoster Virus Activity of Some Novel Bicyclic Nucleoside Inhibitors: Effect of Enhanced Aqueous Solubility

E. De Clercq, A. Brancale, J. Balzarini, 2000, Antiviral chemistry & chemotherapy.

Bicyclic anti-VZV nucleosides: Thieno analogues retain full antiviral activity.

P. Savy, E. De Clercq, A. Brancale, 2001, Bioorganic & medicinal chemistry letters.

Virtual Screening of Acyclovir Derivatives as Potential Antiviral Agents: Design, Synthesis, and Biological Evaluation of New Acyclic Nucleoside ProTides.

A. Brancale, L. Margolis, J. Balzarini, 2017, Journal of medicinal chemistry.

Identification of 6-(piperazin-1-yl)-1,3,5-triazine as a chemical scaffold with broad anti-schistosomal activities.

A. Brancale, K. Hoffmann, G. Padalino, 2020, Wellcome open research.

Combining bioinformatics, cheminformatics, functional genomics and whole organism approaches for identifying epigenetic drug targets in Schistosoma mansoni

A. Brancale, K. Hoffmann, G. Padalino, 2018, International journal for parasitology. Drugs and drug resistance.

Small-molecule inhibitors of 25-hydroxyvitamin D-24-hydroxylase (CYP24A1): synthesis and biological evaluation.

H. DeLuca, A. Brancale, C. Simons, 2014, Journal of medicinal chemistry.

Molecular Modelling Study of the 3D Structure of the Bovine Viral Diarrhea Virus (BVDV) Helicase

Dimitrios Vlachakis, Andrea Brancale, Chrisanthy Vlachaki, 2008, Silico Biol..

Design of Photocontrolled RNA‐Binding Peptidomimetics

A. Brancale, R. Mart, A. Ricci, 2012, Chembiochem : a European journal of chemical biology.

Rational modifications, synthesis and biological evaluation of new potential antivirals for RSV designed to target the M2-1 protein.

A. Brancale, J. Neyts, D. Jochmans, 2020, Bioorganic & medicinal chemistry.

SARS-CoV-2 Virus−Host Interaction: Currently Available Structures and Implications of Variant Emergence on Infectivity and Immune Response

A. Brancale, J. Mesquita, M. Bassetto, 2021, International journal of molecular sciences.

A Rational Design of α-Helix-Shaped Peptides Employing the Hydrogen-Bond Surrogate Approach: A Modulation Strategy for Ras-RasGRF1 Interaction in Neuropsychiatric Disorders

Maria Rita Gulotta, A. Brancale, R. Brambilla, 2021, Pharmaceuticals.

Chiral Indolylarylsulfone Non-Nucleoside Reverse Transcriptase Inhibitors as New Potent and Broad Spectrum Anti-HIV-1 Agents.

C. Limatola, E. Novellino, A. Coluccia, 2017, Journal of medicinal chemistry.

Design, Synthesis, and Biological Evaluation of 6-Substituted Thieno[3,2- d]pyrimidine Analogues as Dual Epidermal Growth Factor Receptor Kinase and Microtubule Inhibitors.

A. Brancale, G. Viola, Roberta Bortolozzi, 2019, Journal of medicinal chemistry.

Mo1316 Structural and Dynamic Features of Plecanatide: Insights From Molecular Dynamics Simulations

K. Shailubhai, A. Brancale, A. Ricci, 2016 .

Structure property relationships of N-acylsulfonamides and related bioisosteres.

A. Brancale, M. Kozlowski, C. Ballatore, 2021, European journal of medicinal chemistry.

A Computer-Based Methodology to Design Non-Standard Peptides Potentially Able to Prevent HOX-PBX1-Associated Cancer Diseases

Maria Rita Gulotta, A. Brancale, Ugo Perricone, 2021, International journal of molecular sciences.

Fluoxetine Inhibits Enterovirus Replication by Targeting the Viral 2C Protein in a Stereospecific Manner

T. Langer, B. Coutard, A. Brancale, 2019, ACS infectious diseases.

Carcinogen-induced DNA structural distortion differences in the RAS gene isoforms; the importance of local sequence

A. Brancale, I. Prior, S. Reed, 2021, BMC Chemistry.

Molecular Modelling Studies on the Binding of Some Protides to the Putative Human Phosphoramidase Hint1

A. Brancale, C. Mcguigan, C. Congiatu, 2007, Nucleosides, nucleotides & nucleic acids.

Substituted 2-(3',4',5'-trimethoxybenzoyl)-benzo[b]thiophene derivatives as potent tubulin polymerization inhibitors.

A. Brancale, O. Cruz-López, J. Balzarini, 2010, Bioorganic & Medicinal Chemistry.

Design, synthesis and in vitro anticancer evaluation of 4,6-diamino-1,3,5-triazine-2-carbohydrazides and -carboxamides.

A. Brancale, M. Shekhar, A. Westwell, 2013, Bioorganic & medicinal chemistry letters.

Potent, long-acting cyclopentane-1,3-Dione thromboxane (A2)-receptor antagonists.

J. Trojanowski, V. Lee, A. Brancale, 2014, ACS medicinal chemistry letters.

3-Aroyl-1,4-diarylpyrroles Inhibit Chronic Myeloid Leukemia Cell Growth through an Interaction with Tubulin.

A. Coluccia, A. Brancale, R. Silvestri, 2017, ACS medicinal chemistry letters.

Small molecules targeted to the microtubule–Hec1 interaction inhibit cancer cell growth through microtubule stabilization

D. Trisciuoglio, E. Cundari, A. Brancale, 2017, Oncogene.

A novel interaction between dengue virus nonstructural protein 1 and the NS4A-2K-4B precursor is required for viral RNA replication but not for formation of the membranous replication organelle

A. Pichlmair, R. Bartenschlager, A. Brancale, 2019, PLoS pathogens.

Synthesis and biological evaluation of 6-substituted-5-fluorouridine ProTides.

A. Brancale, C. Mcguigan, S. Ferla, 2017, Bioorganic & medicinal chemistry.

Density functional theory calculation of cyclic carboxylic phosphorus mixed anhydrides as possible intermediates in biochemical reactions: Implications for the Pro‐Tide approach

Andrea Brancale, Antonio Ricci, A. Brancale, 2012, J. Comput. Chem..

Diketo acids inhibit the cap-snatching endonuclease of several Bunyavirales.

S. Günther, A. Brancale, J. Neyts, 2020, Antiviral research.

Modeling Epac1 interactions with the allosteric inhibitor AM-001 by co-solvent molecular dynamics

Antonio Coluccia, Marianna Bufano, Marion Laudette, 2020, Journal of Computer-Aided Molecular Design.

Targeting the Complement Serine Protease MASP-2 as a Therapeutic Strategy for Coronavirus Infections

A. Brancale, M. Heurich, Giulio Nannetti, 2021, Viruses.

The ying and yang of idebenone: Not too little, not too much - cell death in NQO1 deficient cells and the mouse retina.

B. Newland, M. Votruba, A. Brancale, 2019, Free radical biology & medicine.

Rational design and synthesis of novel phenylsulfonyl-benzamides as anti-prostate cancer agents† †The authors declare no competing interests. ‡ ‡Electronic supplementary information (ESI) available. See DOI: 10.1039/c7md00164a § §This work is dedicated to the memory of Prof. Chris McGuigan, a great

A. Brancale, A. Westwell, C. Mcguigan, 2017, MedChemComm.

Discovery of novel dengue virus NS5 methyltransferase non-nucleoside inhibitors by fragment-based drug design.

Andrea Brancale, Bruno Coutard, B. Coutard, 2017, European journal of medicinal chemistry.

The Discovery of a Novel Antimetastatic Bcl3 Inhibitor

A. Gruca, A. Brancale, A. Westwell, 2021, Molecular Cancer Therapeutics.

Focal drug administration via heparin-containing cryogel microcarriers reduces cancer growth and metastasis.

B. Newland, C. Werner, A. Brancale, 2020, Carbohydrate polymers.

S[+] Apomorphine is a CNS penetrating activator of the Nrf2-ARE pathway with activity in mouse and patient fibroblast models of amyotrophic lateral sclerosis☆

A. Higginbottom, A. Coluccia, A. Brancale, 2013, Free radical biology & medicine.

Chemical modulation of Schistosoma mansoni lysine specific demethylase 1 (SmLSD1) induces wide-scale biological and epigenomic changes

H. Rienhoff, A. Brancale, C. Grunau, 2023, Wellcome open research.

Pointer Advanced in silico approaches in antiviral research

Nicola Zonta, Andrea Brancale, Antonio Coluccia, 2010 .

Importance of single molecular determinants in the fidelity of expanded genetic codes

A. Brancale, H. Czapinska, M. Bochtler, 2011, Proceedings of the National Academy of Sciences.

Shape-based virtual screening, synthesis and evaluation of novel pyrrolone derivatives as antiviral agents against HCV.

A. Brancale, J. Neyts, P. Leyssen, 2017, Bioorganic & medicinal chemistry letters.

Identification of a novel P2X7 antagonist using structure-based virtual screening

A. Brancale, Gaia Pasqualetto, Marika Zuanon, 2023, Frontiers in Pharmacology.

Synthesis and antiviral effect of novel fluoxetine analogues as enterovirus 2C inhibitors.

B. Coutard, A. Brancale, F. V. van Kuppeveld, 2020, Antiviral research.

Synthesis, in vitro and in vivo biological evaluation of substituted 3-(5-imidazo[2,1-b]thiazolylmethylene)-2-indolinones as new potent anticancer agents.

A. Brancale, G. Viola, Roberta Bortolozzi, 2019, European journal of medicinal chemistry.

2-Alkoxycarbonyl-3-arylamino-5-substituted thiophenes as a novel class of antimicrotubule agents: Design, synthesis, cell growth and tubulin polymerization inhibition.

A. Brancale, G. Basso, G. Viola, 2018, European journal of medicinal chemistry.

Drosophila taste neurons as an agonist-screening platform for P2X receptors

A. Brancale, M. Young, P. Kemp, 2020, Scientific Reports.

Fluoxetine targets an allosteric site in the enterovirus 2C AAA+ ATPase and stabilizes a ring-shaped hexameric complex

B. Coutard, J. Snijder, T. Zeev-Ben-Mordehai, 2022, Science advances.

Fluoxetine targets an allosteric site in the enterovirus 2C AAA+ ATPase and stabilizes the hexameric complex

F. Förster, B. Coutard, T. Zeev-Ben-Mordehai, 2021, bioRxiv.

Synthesis and CYP24A1 inhibitory activity of N-(2-(1H-imidazol-1-yl)-2-phenylethyl)arylamides.

S. Yee, A. Brancale, Glenville Jones, 2010, Bioorganic & medicinal chemistry.

Design and synthesis of novel bicalutamide and enzalutamide derivatives as antiproliferative agents for the treatment of prostate cancer.

A. Brancale, A. Westwell, C. Mcguigan, 2016, European journal of medicinal chemistry.

The Molecular Determinants of Small-Molecule Ligand Binding at P2X Receptors

A. Brancale, M. Young, Gaia Pasqualetto, 2018, Front. Pharmacol..

In silico screening for human norovirus antivirals reveals a novel non-nucleoside inhibitor of the viral polymerase

A. Brancale, P. White, S. Guccione, 2018, Scientific Reports.

A new antiviral scaffold for human norovirus identified with computer-aided approaches on the viral polymerase

A. Brancale, J. Neyts, M. Young, 2019, Scientific Reports.

Amyloid-Associated Nucleic Acid Hybridisation

T. Dale, A. Brancale, M. Bochtler, 2011, PloS one.

Biocatalytic and Chemo-Enzymatic Synthesis of Quinolines and 2-Quinolones by Monoamine Oxidase (MAO-N) and Horseradish Peroxidase (HRP) Biocatalysts

A. Brancale, N. Turner, G. Black, 2023, ACS catalysis.

Structure-Activity Relationships, Tolerability and Efficacy of Microtubule-Active 1,2,4-Triazolo[1,5-a]pyrimidines as Potential Candidates to Treat Human African Trypanosomiasis

A. Brancale, C. Caffrey, K. Brunden, 2023, bioRxiv.

Homology Modelling of Human E1 Ubiquitin Activating Enzyme.

A. Brancale, A. Westwell, A. Burger, 2010, Letters in drug design & discovery.

Rational design and synthesis of novel anti-prostate cancer agents bearing a 3,5-bis-trifluoromethylphenyl moiety.

A. Brancale, A. Westwell, C. Mcguigan, 2016, Bioorganic & medicinal chemistry letters.

Geneticin shows selective antiviral activity against SARS-CoV-2 by interfering with programmed −1 ribosomal frameshifting

A. Brancale, C. Bertelli, V. Cagno, 2022, bioRxiv.

Homology model of 1α,25-dihydroxyvitamin D3 24-hydroxylase cytochrome P450 24A1 (CYP24A1): Active site architecture and ligand binding

Andrea Brancale, A. Brancale, C. Simons, 2007, The Journal of Steroid Biochemistry and Molecular Biology.

New nitrogen containing substituents at the indole-2-carboxamide yield high potent and broad spectrum indolylarylsulfone HIV-1 non-nucleoside reverse transcriptase inhibitors.

E. Novellino, B. Clotet, A. Coluccia, 2012, Journal of medicinal chemistry.

Phage display identification of functional binding peptides against 4-acetamidophenol (Paracetamol): an exemplified approach to target low molecular weight organic molecules.

A. Brancale, M. Gumbleton, C. Allender, 2007, Biochemical and biophysical research communications.

Microtubule-Stabilizing 1,2,4-Triazolo[1,5-a]pyrimidines as Candidate Therapeutics for Neurodegenerative Disease: Matched Molecular Pair Analyses and Computational Studies Reveal New Structure–Activity Insights

Virginia M. Y. Lee, A. Brancale, Amos B. Smith, 2022, Journal of medicinal chemistry.

GPU‐accelerated molecular mechanics computations

Ian J. Grimstead, Andrea Brancale, Athanasios Anthopoulos, 2013, J. Comput. Chem..

Computer-aided identification of novel anticancer compounds with a possible dual HER1/HER2 inhibition mechanism.

A. Brancale, S. Hiscox, K. Amin, 2015, Bioorganic & medicinal chemistry letters.

Small molecule inhibitors of 25 hydroxyvitamin D 24 hydroxylase ( CYP 24 A 1 ) : synthesis and biological evaluation

Jinge, H. DeLuca, A. Brancale, 2019 .

Synthesis and Biological Evaluation of 2-Substituted Benzyl-/Phenylethylamino-4-amino-5-aroylthiazoles as Apoptosis-Inducing Anticancer Agents

A. Brancale, S. Manfredini, R. Romagnoli, 2020, Molecules.

Design and synthesis of substituted imidazole and triazole N-phenylbenzo[d]oxazolamine inhibitors of retinoic acid metabolizing enzyme CYP26.

A. Brancale, C. Simons, M. Coogan, 2009, Journal of enzyme inhibition and medicinal chemistry.

Indolylarylsulfones as HIV-1 non-nucleoside reverse transcriptase inhibitors: new cyclic substituents at the indole-2-carboxamide

E. Novellino, A. Coluccia, A. Brancale, 2011 .

Haptic-driven applications to molecular modeling: state-of-the-art and perspectives.

Andrea Brancale, Athanasios Anthopoulos, Antonio Ricci, 2012, Future medicinal chemistry.

Chiral Indolylarylsulfone Non-Nucleoside Reverse Transcriptase Inhibitors as New Potent and Broad Spectrum Anti-HIV-1 Agents.

C. Limatola, E. Novellino, A. Coluccia, 2017, Journal of medicinal chemistry.

Novel styryl-indoles as small molecule inhibitors of 25-hydroxyvitamin D-24-hydroxylase (CYP24A1): Synthesis and biological evaluation.

H. DeLuca, A. Brancale, C. Simons, 2014, European journal of medicinal chemistry.

Networks of enzymatically oxidized membrane lipids support calcium-dependent coagulation factor binding to maintain hemostasis

Christopher P. Thomas, P. Taylor, D. Farewell, 2017, Science Signaling.

1 Design , Synthesis and Biological Evaluation of 6-Substituted Thieno [ 3 , 2-d ] pyrimidine Analogues as Dual Epidermal Growth Factor Receptor Kinase and Microtubule Inhibitors

A. Brancale, L. C. López-Cara, R. Romagnoli, 2022 .

In silico identification, design and synthesis of novel piperazine-based antiviral agents targeting the hepatitis C virus helicase.

A. Brancale, J. Neyts, P. Leyssen, 2017, European journal of medicinal chemistry.

IJP: Drugs and Drug Resistance

A. Brancale, M. K. Nielsen, J. Scare, 2018 .

Impairment of cocaine-mediated behaviours in mice by clinically relevant Ras-ERK inhibitors

R. Spanagel, A. Brancale, S. Fasano, 2016, eLife.

The Tubulin Colchicine Domain: a Molecular Modeling Perspective

A. Brancale, R. Silvestri, A. Massarotti, 2012, ChemMedChem.

Design, synthesis, and biological investigation of selective human carbonic anhydrase II, IX, and XII inhibitors using 7-aryl/heteroaryl triazolopyrimidines bearing a sulfanilamide scaffold

C. Supuran, A. Brancale, Roberta Bortolozzi, 2023, Journal of enzyme inhibition and medicinal chemistry.

Structural biology in antiviral drug discovery

A. Brancale, A. Massarotti, Marcella Bassetto, 2016, Current Opinion in Pharmacology.

New pyrrole derivatives with potent tubulin polymerization inhibiting activity as anticancer agents including hedgehog-dependent cancer.

E. Novellino, L. Di Marcotullio, A. Brancale, 2014, Journal of medicinal chemistry.

Toward highly potent cancer agents by modulating the C-2 group of the arylthioindole class of tubulin polymerization inhibitors.

Y. Ni, E. Novellino, B. Maresca, 2013, Journal of medicinal chemistry.

Design, synthesis, in vitro, and in vivo anticancer and antiangiogenic activity of novel 3-arylaminobenzofuran derivatives targeting the colchicine site on tubulin.

María Kimatrai Salvador, A. Brancale, G. Viola, 2015, Journal of medicinal chemistry.

Base damage, local sequence context and TP53 mutation hotspots: a molecular dynamics study of benzo[a]pyrene induced DNA distortion and mutability

A. Brancale, S. Reed, G. Menzies, 2015, Nucleic acids research.

3-Aryl/Heteroaryl-5-amino-1-(3',4',5'-trimethoxybenzoyl)-1,2,4-triazoles as antimicrotubule agents. Design, synthesis, antiproliferative activity and inhibition of tubulin polymerization.

A. Brancale, G. Viola, Roberta Bortolozzi, 2018, Bioorganic chemistry.

Antiproliferative Activity and Inhibition of Tubulin Polymerization

A. Brancale, R. Romagnoli, Filippo Prencipe, 2023 .

Antiviral Research

A. Brancale, K. Pasunooti, S. Bhat, 2023 .

Small Molecule Inhibitors of West Nile Virus

A. Brancale, A. Massarotti, K. Amin, 2014, Antiviral chemistry & chemotherapy.

Pointer Small molecule inhibitors of West Nile virus

A. Brancale, A. Massarotti, K. Amin, 2014 .

Homology model of 1alpha,25-dihydroxyvitamin D3 24-hydroxylase cytochrome P450 24A1 (CYP24A1): active site architecture and ligand binding.

A. Brancale, C. Simons, M. Gomaa, 2007, The Journal of steroid biochemistry and molecular biology.