Publications by authors named "Kamal Azzaoui"

17Publications

NMR quality control of fragment libraries for screening.

J Biomol NMR 2020 Nov 12;74(10-11):555-563. Epub 2020 Jun 12.

Center for Biomolecular Magnetic Resonance (BMRZ), Institute for Organic Chemistry and Chemical Biology, Goethe University, Frankfurt, Germany.

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November 2020

Computational methods for early predictive safety assessment from biological and chemical data.

Expert Opin Drug Metab Toxicol 2011 Dec 4;7(12):1497-511. Epub 2011 Nov 4.

Novartis Institutes for BioMedical Research, Inc., Chemical Biology Informatics, Quantitative Biology, Developmental and Molecular Pathways, 220 Massachusetts Avenue, 02139 Cambridge, MA, USA.

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December 2011

In vitro safety pharmacology profiling: what else beyond hERG?

Future Med Chem 2009 Jul;1(4):645-65

Center for Proteomic Chemistry, Novartis Pharma AG, Forum 1, 4002 Basel, Switzerland.

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July 2009

Gaining insight into off-target mediated effects of drug candidates with a comprehensive systems chemical biology analysis.

J Chem Inf Model 2009 Feb;49(2):308-17

Lead Discovery Informatics and Preclinical Safety Profiling, CPC, Novartis Institutes for Biomedical Research, 250 Massachussetts Avenue, Cambridge, Massachusetts 02139, USA.

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February 2009

Mapping adverse drug reactions in chemical space.

J Med Chem 2009 May;52(9):3103-7

Lead Discovery Informatics, CPC, Novartis Institutes for Biomedical Research, 250 Massachussetts Avenue, Cambridge, Massachusetts 02139, USA.

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May 2009

Modeling promiscuity based on in vitro safety pharmacology profiling data.

ChemMedChem 2007 Jun;2(6):874-80

CPC/LFP/MLI, Novartis Institutes for Biomedical Research, Novartis Pharma AG, Postfach, 4002 Basel, Switzerland.

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June 2007

Analysis of pharmacology data and the prediction of adverse drug reactions and off-target effects from chemical structure.

ChemMedChem 2007 Jun;2(6):861-73

Lead Finding Platform, Novartis Institutes for BioMedical Research Inc. 250 Massachusetts Ave., Cambridge, Massachusetts 02139, USA.

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June 2007

New methods for ligand-based virtual screening: use of data fusion and machine learning to enhance the effectiveness of similarity searching.

J Chem Inf Model 2006 Mar-Apr;46(2):462-70

Krebs Institute for Biomolecular Research and Department of Information Studies, University of Sheffield, Western Bank, Sheffield S10 2TN, U.K.

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September 2006

A chemoinformatics analysis of hit lists obtained from high-throughput affinity-selection screening.

J Biomol Screen 2006 Mar 16;11(2):123-30. Epub 2005 Dec 16.

Novartis Institutes for BioMedical Research, Basel, Switzerland.

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March 2006

Enhancing the effectiveness of similarity-based virtual screening using nearest-neighbor information.

J Med Chem 2005 Nov;48(22):7049-54

Krebs Institute for Biomolecular Research and Department of Information Studies, University of Sheffield, Western Bank, Sheffield S10 2TN, U.K.

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November 2005

Comparison of topological descriptors for similarity-based virtual screening using multiple bioactive reference structures.

Org Biomol Chem 2004 Nov 29;2(22):3256-66. Epub 2004 Sep 29.

Krebs Institute for Biomolecular Research and Department of Information Studies, University of Sheffield, Western Bank, Sheffield S10 2TN, UK.

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November 2004

Comparison of fingerprint-based methods for virtual screening using multiple bioactive reference structures.

J Chem Inf Comput Sci 2004 May-Jun;44(3):1177-85

Krebs Institute for Biomolecular Research and Department of Information Studies, University of Sheffield, Western Bank, Sheffield S10 2TN, UK.

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March 2005