Finton Sirockin - Publications, H-index & Citations

Finton Sirockin

novartis biomedical research, novartis campus, 4002 basel, switzerland

18H指数

59论文数

969被引数

收录论文 14

发表时间

The changing landscape of medicinal chemistry optimization 药物化学优化的变化格局

Nature Reviews Drug Discovery

IF101.8

2025-07-07

PREAI

Anita Rácz; Levente M. Mihalovits; Maximilian Beckers; Nikolas Fechner; Nikolaus Stiefl; Finton Sirockin; William McCoull; Emma Evertsson; Malin Lemurell; Gergely Makara; György M. Keserű

Scaffold Hopping with Generative Reinforcement Learning 生成强化学习驱动的骨架跳跃

Journal of Chemical Information and Modeling

IF5.3

2025-06-26

OAAI

Luke Rossen; Finton Sirockin; Nadine Schneider; Francesca Grisoni

Balancing Molecular Size, Activity, Permeability, and Other Properties: Drug Candidates in the Context of Their Chemical Structure Optimization

JOURNAL OF CHEMICAL INFORMATION AND MODELING

IF5.3

2024-08-13

PREAI

Beckers, Maximilian; Sirockin, Finton; Fechner, Nikolas; Stiefl, Nikolaus

Prediction of Small-Molecule Developability Using Large-Scale In Silico ADMET Models

JOURNAL OF MEDICINAL CHEMISTRY

IF6.8

2023-10-10

PREAI

Beckers, Maximilian; Sturm, Noe; Sirockin, Finton; Fechner, Nikolas; Stiefl, Nikolaus

PREFER: A New Predictive Modeling Framework for Molecular Discovery

JOURNAL OF CHEMICAL INFORMATION AND MODELING

IF5.3

2023-07-24

PREAI

Lanini, Jessica; Santarossa, Gianluca; Sirockin, Finton; Lewis, Richard; Fechner, Nikolas; Misztela, Hubert; Lewis, Sarah; Maziarz, Krzysztof; Stanley, Megan; Segler, Marwin; Stiefl, Nikolaus; Schneider, Nadine

CAVIAR: a method for automatic cavity detection, description and decomposition into subcavities

JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN

IF3.1

2021-05-29

PREAI

Marchand, Jean-Remy; Pirard, Bernard; Ertl, Peter; Sirockin, Finton

Discovery of 4-((2S,4S)-4-Ethoxy-1-((5-methoxy-7-methyl-1H-indol-4-yl)methyl)piperidin-2-yl)benzoic Acid (LNP023), a Factor B Inhibitor Specifically Designed To Be Applicable to Treating a Diverse Array of Complement Mediated Diseases

JOURNAL OF MEDICINAL CHEMISTRY

IF6.8

2020-02-19

PREAI

Mainolfi, Nello; Ehara, Takeru; Karki, Rajeshri G.; Anderson, Karen; Mac Sweeney, Aengus; Liao, Sha-Mei; Argikar, Upendra A.; Jendza, Keith; Zhang, Chun; Powers, James; Klosowski, Daniel W.; Crowley, Maura; Kawanami, Toshio; Ding, Jian; April, Myriam; Forster, Cornelia; Serrano-Wu, Michael; Capparelli, Michael; Ramqaj, Rrezarta; Solovay, Catherine; Cumin, Frederic; Smith, Thomas M.; Ferrara, Luciana; Lee, Wendy; Long, Debby; Prentiss, Melissa; De Erkenez, Andrea; Yang, Louis; Liu, Fang; Sellner, Holger; Sirockin, Finton; Valeur, Eric; Erbel, Paulus; Ostermeier, Daniela; Ramage, Paul; Gerhartz, Bernd; Schubart, Anna; Flohr, Stefanie; Gradoux, Nathalie; Feifel, Roland; Vogg, Barbara; Wiesmann, Christian; Maibaum, Juergen; Eder, Joerg; Sedrani, Richard; Harrison, Richard A.; Mogi, Muneto; Jaffee, Bruce D.; Adams, Christopher M.

Small-molecule factor B inhibitor for the treatment of complement-mediated diseases

PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

IF9.1

2019-03-29

153

OAAI

Schubart, Anna; Anderson, Karen; Mainolfi, Nello; Sellner, Holger; Ehara, Takeru; Adams, Christopher M.; Mac Sweeney, Aengus; Liao, Sha-Mei; Crowley, Maura; Littlewood-Evans, Amanda; Sarret, Sophie; Wieczorek, Grazyna; Perrot, Ludovic; Dubost, Valerie; Flandre, Thierry; Zhang, Yuzhou; Smith, Richard J. H.; Risitano, Antonio M.; Karki, Rajeshri G.; Zhang, Chun; Valeur, Eric; Sirockin, Finton; Gerhartz, Bernd; Erbel, Paulus; Hughes, Nicola; Smith, Thomas M.; Cumin, Frederic; Argikar, Upendra A.; Haraldsson, Boerje; Mogi, Muneto; Sedrani, Richard; Wiesmann, Christian; Jaffee, Bruce; Maibaum, Juergen; Flohr, Stefanie; Harrison, Richard; Eder, Joerg

Drug Analogs from Fragment-Based Long Short-Term Memory Generative Neural Networks 基于片段的长短期记忆生成神经网络的药物类似物

JOURNAL OF CHEMICAL INFORMATION AND MODELING

IF5.3

2019-03-25

OAAI

Awale, Mahendra; Sirockin, Finton; Stiefl, Nikolaus; Reymond, Jean-Louis

Discovery and Structure-Based Optimization of Adenain Inhibitors

ACS MEDICINAL CHEMISTRY LETTERS

IF4

2014-06-24

OAAI

Mac Sweeney, Aengus; Grosche, Philipp; Ellis, David; Combrink, Keith; Erbel, Paul; Hughes, Nicola; Sirockin, Finton; Melkko, Samu; Bernardi, Anna; Ramage, Paul; Jarousse, Nadine; Altmann, Eva

Design, Synthesis, and Functional Evaluation of Leukocyte Function Associated Antigen-1 Antagonists in Early and Late Stages of Cancer Development

JOURNAL OF MEDICINAL CHEMISTRY

IF6.8

2013-01-22

PREAI

San Sebastian, Eider; Zimmerman, Tahl; Zubia, Aizpea; Vara, Yosu; Martin, Elyette; Sirockin, Finton; Dejaegere, Annick; Stote, Roland H.; Lo, Xabier; Pantoja-Uceda, David; Valcarcel, Maria; Mendoza, Lorca; Vidal-Vanaclocha, Fernando; Cossio, Fernando P.; Blanco, Francisco J.

Elastic Potential Grids: Accurate and Efficient Representation of Intermolecular Interactions for Fully Flexible Docking

CHEMMEDCHEM

IF3.4

2009-07-30

PREAI

Kazemi, Sina; Krueger, Dennis M.; Sirockin, Finton; Gohlke, Holger

Functionality maps of the ATP binding site of DNA gyrase B: Generation of a consensus model of ligand binding

JOURNAL OF MEDICINAL CHEMISTRY

IF6.8

2004-07-29

PREAI

Schechner, M; Sirockin, F; Stote, RH; Dejaegere, AP