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Page 1: Global Pharma R&D Informatics Congress€¦ · • AI and Machine ... Leveraging IoT in the Lab. ... The success of the pharmaceutical industry has as its foundation a richness of

30 Nov-1 Dec 2017LISBON, PORTUGAL

GLOBAL PHARMA R&D INFORMATICS

CONGRESS

www.global-engage .com

#GEPRD17

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WARM WELCOME

Global Engage are pleased to announce the Global Pharma R&D Informatics Congress. The meeting will be held in Lisbon, Portugal and will take place on 30th November-1st December 2017.

Data is constantly being generated in the pharmaceutical industry from a wide number of sources creating opportunities to extract new insights into how diseases work and how drugs can be developed to provide targeted and effective treatments. This is only possible, though, if pharma and biotech companies can structure, integrate, and analyse large volumes of data to derive useful knowledge from it.

This congress looks at new methods and new technologies that get the best out of the information available and strategies to integrate internal and external systems so that all teams get the information they need to accelerate the drug development pipeline. Attracting experts working in all areas of pharmaceutical R&D IT and discovery informatics, the event will focus on innovations and strategies in these 4 key topic areas:

• Complex Data Analytics

• System Integration

• AI and Machine Learning

• Data Storage and Management

The conference will provide an interactive networking forum to both further develop and answer your queries through a vibrant exhibition room full of solution providers showcasing their technologies and software, poster presentation sessions, roundtable discussions, a dynamic panel discussion, and interactive Q&A sessions from a 40-strong speaker faculty examining the latest developments in the field.

TUDOR OPREAProfessor and Chief of

Translational Informatics, University of New Mexico, USA

MARGRET ASSFALGGlobal Head, Research Informatics

and Discovery Workflows, Roche

EXPERT SPEAKERS Include:

JOHN BALDONISVP, InSilico Drug Discovery Unit,

GSK

DEREK MARRENDirector of IT,

Eli Lilly and Company

GLOBAL PHARMA R&D INFORMATICS CONGRESS 2017

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DAY 1 & 2 – TRACK 1 COMPLEX DATA ANALYTICS & METHOD DEVELOPMENT

• Big data management systems for research and clinical trials• Knowledge representation and visualisation• Improving data usability for different teams• ELN and LIMS development• Data mining methods• In silico modelling• Statistical significance analysis• Data searching and algorithms• Utilising real-world evidence and clinical trial feedback to improve the

drug development process• Sensitive data collection• Maintaining high quality data• Publication pooling and automated text mining• Repurposing archived data• Improving user interfaces

CONFERENCE SYNOPSIS

DAY 1, TRACK 2 – SYSTEM INTEGRATION AND WORKFLOW OPTIMISATION

• SDMS implementation and optimisation• Automating workflow streamlining• Integrating heterogenous data sets• Integrating different software and hardware systems• Knowledge management• Managing system changes and discontinued packages• Using publication data to improve your own research• Software for distributed computing• Internal and External data sharing and collaboration• Cross-discipline collaboration strategies• Internal workflow management

DAY 2, TRACK 2A) AI AND MACHINE LEARNING

• Deep learning• Automation• Intelligent workflow systems• Implementing machine learning systems for improved target and

biomarker discovery and validation• Next steps for AI• Virtual compound modelling and virtual screening• Computer aided drug design

DAY 2, TRACK 2B) DATA STORAGE AND MANAGEMENT

• Data storage and maintenance methods• Cloud storage• Data Archiving methods• Centralised data integration and accessibility for research and

clinical trials• Panel Discussion - The Current Challenges of Data Security and

Regulation for the Pharmaceutical IndustryROUNDTABLE DISCUSSIONS

1. Data standardisation within smart lab systems2. Virtual compound modelling3. Integrating systems to improve user interfaces4. Leveraging IoT in the Lab

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SPONSORS & EXHIBITORS

Exhibitors & Content Sponsors

Platinum Sponsor

Supporters

Gold Sponsor

Silver Sponsor

GLOBAL PHARMA R&D INFORMATICS CONGRESS 2017

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CONFIRMED SPEAKERS

MARGRET ASSFALGGlobal Head, Research Informatics and Discovery Workflows, Roche

VAIBHAV NARAYANVice President, Research and Therapeutic Area IT, Janssen Pharmaceuticals LLC

JOHN BALDONISVP, InSilico Drug Discovery Unit, GSK

TUDOR OPREAProfessor and Chief of Translational Informatics, University of New Mexico, USA

JONNY WRAYHead of Discovery Informatics, e-Therapeutics

ASIM SIDDIQUICTO, Numedii

ALEXANDER KRUPPHead of Computational Life Science IT, Pharmaceuticals R&D, Bayer

JEREMY EDMUNDSDirector of Immunology Chemistry, AbbVie

FRIEDRICH RIPPMANNDirector of Computational Chemistry and Biology, Merck KGaA

SOPHIA ANANIADOUDirector, National Centre for Text Mining and Professor of Computer Science, University of Manchester, UK

BURKHARD SCHAEFERPresident, BSSN Software GmbH

JAY BERGERONDirector of Translational and Bioinformatics, Pfizer

DANIEL JUCHLICTO, Standardization in Lab Automation (SiLA)

JENNIFER HEYMONTSenior Data Scientist, Eisai AiM

DIMITAR HRISTOZOVTeam Leader, Research Informatics, Evotec

MARIE HELENE ANDERSSONSenior Manager, IT Strategy and Knowledge Management, Global Pharmaceutical R&D, Ferring Pharmaceuticals,

DEREK MARRENDirector of IT, Eli Lilly and Company

BRANDON ALLGOODCTO and Co-Founder, Numerate Inc

JAMES LUMLEYSenior Scientist, Informatics, Eli Lilly and Company

WILLEM VAN HOORNHead of ChemoInformatics, Exscientia

MICHAL FOJTAKResearch Consultant, Biology Results & Neuroscience IT, Eli Lilly and Company

ALEX ARONOVHead of Global Research Informatics, Vertex Pharmaceuticals

JAMES WILLANSChief Technology Officer, Lhasa Limited

ARNAUD SARTREGlobal Laboratory Informatics Senior Manager, Pfizer

MARTIN SJÖHOLMSenior Architect, Computational Life Science IT, Bayer

OLIVER KOCHGroup Leader, Medicinal Chemistry, Technical University of Dortmund, Germany

BIN CHENAssistant Professor, University of California San Francisco, USA

HANS DE BIESenior Director Solution Delivery, ACD/Labs

EDDY VANDE WATERSenior Director, BIOVIA Field Applications

JENNIFER RUSSO WORTMAN Senior Director, Bioinformatics, Seres Therapeutics, USA

ARIE BAAKCo-founder, Euretos

DANIELA JANSENDirector of Solution Marketing, Dassault Systèmes BIOVIA

LAURENCE PAINELLVP, Marketing, IDBS

VASANT HONAVARProfessor and Edward Frymoyer Chair of Information Sciences and Technology, Director of the Artificial

Intelligence Research Laboratory and the Center for Big Data Analytics and Discovery Informatics, Pennsylvania State University, USA

JOHN DAVISLead Scientist, Operational Technology and Informatics, Lonza Biologics

PETER SCHMIDTKEScientific Project Manager, Discngine

CONOR SCULLY (Track Chair)Senior Scientist, Heptares Therapeutics

GUY DESMARQUETSDirector of Strategy and Business Development, Software Solutions and Informatics Services, Bruker

IRINA EFIMENKOFounder and CEO, Semantic Hub

GLOBAL PHARMA R&D INFORMATICS CONGRESS 2017

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CONGRESS SCHEDULE

Registration & Refreshments08:00-08:50

08:50-09:00

DAY 1 THURSDAY 30TH NOVEMBER 2017

KEYNOTE ADDRESS:VAIBHAV NARAYANVice President, Research and Therapeutic Area IT, Janssen Pharmaceuticals LLCInformatics of Early Disease Interception• Therapeutic interventions have traditionally been developed for patients with established pathologies and overt clinical symptoms. However, many diseases are not tractable in later stages and therefore therapies will need developed that intervene earlier in the disease continuum.

• While earlier disease interception can be of considerable value to patients and the health care system, many barriers exist in the successful discover and development of early stage therapeutics. These range from early science challenges, e.g. understanding of causative biological processes that lead to full blown pathology, to more downstream challenges such as demonstrating therapeutic benefit in patients with minimal symptoms or clinical deficits. This talk explores how Informatics and ‘Big Data’ can help address these challenges and enable discovery and development of ‘disease intercepting’ therapeutics.

Morning Refreshments / One-to-One Meetings10:40-11:50

COMPLEX DATA ANALYTICS AND METHOD DEVELOPMENT SYSTEM INTEGRATION AND WORKFLOW OPTIMISATION09:00-09:40

KEYNOTE ADDRESS:JOHN BALDONISVP, InSilico Drug Discovery Unit, GSKATOM – Accelerating Therapeutics for Opportunities in MedicineThe success of the pharmaceutical industry has as its foundation a richness of failed programs. Those failed programs contain much more information than those that have succeeded. In a world of high performance computing these failed

data have great value as the drug discovery process is modernized. ATOM was created to integrate high performance computing, scientific expertise in cancer, cutting edge technology and deep data sources that have historically not been available to researchers. ATOM is a precompetitive, public/private partnership established to create a place for like-minded organizations to come together to create new workflows for drug discovery, using cancer as the exemplar disease.

09:40-10:1010:10-10:40

SOLUTION PROVIDER PRESENTATION:EDDY VANDE WATERSenior Director, BIOVIA Field ApplicationsConnecting Data and People to Drive Scientific Decision Making• Pharma R&D Innovation is not hindered by the lack of scientific data. The challenge is the capture, access and analysis of large amounts of data generated throughout the product lifecycle (big data) and the disrupted decision workflow. • Organizations need to make sure to capture and store data and their context for advanced analytics and machine

learning for faster and better insights. And they need to enable collaboration by connecting data and people so the data flow provides decision makers with relevant information.

• This presentation covers scientific decision process challenges, possible workflow improvements, examples of advanced analytics and how a platform-based strategy can deliver data, information and knowledge to the right people at the right time and provide R&D organizations with a competitive advantage.

Global Engage Welcome Address and Track Chair's Opening Remarks: Conor Scully, Senior Scientist, Heptares Therapeutics

TRACK CHAIR: LAURENCE PAINELL, VP, Marketing, IDBS

TRACK CHAIR: CONOR SCULLY, Senior Scientist, Heptares Therapeutics

Room: Viena

Track 1: Londres A&B

Track 1: Londres A&B Track 2: Madrid A

Room: Viena

GLOBAL PHARMA R&D INFORMATICS CONGRESS 2017

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CONGRESS SCHEDULE DAY 1 THURSDAY 30TH NOVEMBER 2017

JONNY WRAYHead of Discovery Informatics, e-TherapeuticsNetwork Driven Drug Discovery: Development of a computational network biology based approach to early drug discovery• Conceptual foundations of an approach to

early drug discovery that explicitly addresses the complex system level aspects of cellular disease mechanisms.

• The application of the concepts, based on network biology and analytics, to the development of a practical discovery process.

• Details of the implementation of an in silico drug discovery engine, consisting of our proprietary data libraries and computational platform, based on the described conceptual foundations.

• Validation of the approach via phenotypic screening results from a number of internal of projects across a range of biological mechanisms.

12:15-12:40

12:15-12:40

VASANT HONAVARProfessor and Edward Frymoyer Chair of Information Sciences and Technology, Director of the Artificial Intelligence Research Laboratory and the Center for Big Data Analytics and Discovery Informatics, Pennsylvania State University, USA

Virtual Data Infrastructure for Collaborative R&D

TUDOR OPREAProfessor and Chief of Translational Informatics, University of New Mexico, USAIlluminating the Druggable Genome and the Quest for new Drug TargetsThe Illuminating the Druggable Genome

Knowledge Management Center (IDG KMC) evaluates, organizes and distils more than 80 protein-centric and over 20 gene-centric resources for over 20,000 curated human proteins. KMC knowledge graphs (ontologies) are focused on five major branches of the target knowledge tree (tkt): Genotype, Phenotype, Expression, Structure and Function, and Interactions and Pathways, each with appropriate sub-branches (normal vs. disease, gender, etc.). Complex data integration shows that only 3% of the proteome are drug targets associated with mechanism of action (“Tclin”), while 2 out of 5 human proteins lack functional information and disease relevance (“Tdark”). Using advanced analytics and machine learning, tkt knowledge graphs utilize biological systems networks linked predictions (meta-paths) to articulate knowledge via computational assertions, with focus on phenotype/disease associations for target and drug repurposing. More information about IDG KMC is available at http://targetcentral.ws/ (IDG Consortium), https://pharos.nih.gov/idg/index (Targets) and http://drugcentral.org/ (Medicines). Our interactive target-disease explorer is available at http://newdrugtargets.org/.

11:50-12:15

11:50-12:15

ALEXANDER KRUPPHead of Computational Life Science IT, Pharmaceuticals R&D, BayerHow to eat the elephant – getting information integration to work• How to make information architecture a

priority in corporate environments and deliver immediate impact?• Insights into a structured approach to overcome the core

challenges of large enterprises to build key data assets • Best practices in applying this framework to a pharmaceutical

R&D business

12:40-13:10

SOLUTION PROVIDER PRESENTATION:HANS DE BIESenior Director Solution Delivery, ACD/LabsAddressing the challenges of Analytical Data Management in R&D

Analytical data is at the heart of pharmaceutical research and development efforts and often required in response to critical questions raised in regulatory filings, or when there is an irregularity in manufacturing. Many organizations, however, continue to struggle with the variety of different formats, instrument vendors, and search and retrieval of analytical data. Cloud computing, automation, data integrity, and externalization are key topics for organizations looking for new ways to integrate analytical systems into their core informatics stack. In this presentation we will discuss the fundamental underpinnings of automated data capture, data exchange formats, data integrity, and next generation analytical data management systems.

12:40-13:10

SOLUTION PROVIDER PRESENTATION:JOHN DAVISLead Scientist, Operational Technology and Informatics, Lonza BiologicsInformatics Solutions for Cell Line Development

Optimally structured data and harmoniously integrated systems are at the core of an effective laboratory informatics solution. This talk describes a solution developed and implemented at Lonza for Cell Line Development, with focus on the integration of an ELN, Inventory Manager, Cryogenic Vial Scanner and Cell Viability Analysers. Transcription has been eliminated from this process, allowing data to be shared seamlessly between the individual components. As a result, cryopreserved cells are being tracked by the vial, with full audit history and all associated process execution data throughout its entire lifecycle. Individual components of this system and the interfaces were validated for GxP use, preserving data integrity throughout the entire process, giving our customers more security over their data and ensuring quality at source.

Lunch13:10-14:10 Room: Viena

GLOBAL PHARMA R&D INFORMATICS CONGRESS 2017

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CONGRESS SCHEDULE DAY 1 THURSDAY 30TH NOVEMBER 2017

14:35-15:00

14:35-15:00

FRIEDRICH RIPPMANNDirector of Computational Chemistry and Biology, Merck KGaABoosting discovery research productivity by generating novel digital components, and integrating them into coherent workflows

With recent methodological and technological progress, and the increase of relevant electronically accessible data, drug discovery is now on the verge of becoming a truly predictive and, in aspects, even quantitative science. We will highlight the areas of progress, e.g. cryo-Electron Microscopy, large-scale virtual compound libraries, Deep Learning-based predictive models, quantitative estimation of binding constants, and will touch on the infrastructure requirements, where large-scale GPU and Cloud Computing play a central role. Towards the goal of Digital Drug Discovery, other areas show great promise as well, ranging from comprehensive Artificial Intelligence-supported workflows, to the computer-assisted “connected” lab. Altogether, a paradigm change towards “leading by design” is under way in the pharma industry. Consequences of this will be discussed, including resources, people attitudes, collaboration, and more.

14:10-14:35

14:10-14:35

MARIE HELENE ANDERSSONSenior Manager, IT Strategy and Knowledge Management, Global Pharmaceutical R&D, Ferring PharmaceuticalsSharing knowledge internally• ‘Data as an asset’ principles• Search, share and access

ASIM SIDDIQUICTO, NumediiTackling rare diseases with big dataThere are an estimated 30,000 diseases and typically only the most common have treatments. To develop therapeutics for all these

conditions, the cost of drug development must be substantially reduced. This can be done by increasing the chances of a drug passing human trials and through the use of drugs for which safety in humans is already known or can be deduced. At NuMedii, we are addressing these points by applying, big data methods that integrate biological knowledge built on trillions of data points. We use AI and machine learning to interpret that information and create drug-disease linkages. Using this approach, we have developed a pipeline in inflammatory disease and oncology with one candidate ready for testing in humans.

15:00-15:30

15:00-15:30

SOLUTION PROVIDER PRESENTATION:PETER SCHMIDTKEScientific Project Manager, Discgine3decision®: Bringing structural data analytics to the masses

Rational structure based drug design techniques are still used in >50% of all drug discovery projects. They strongly rely on structural data for proteins and protein:ligand complexes. Unfortunately, a more widespread adoption of these techniques is hindered by the inconsistent data persistence and the mere complexity of analysing structural data. 3decision® is a structural analytics platform aiming to facilitate and speed up the use of structural data for Molecular Modelers and Medicinal Chemists. It transforms the massive amount of data coming from 3D structures, sequence and other meta data into structural knowledge that you can exploit in your day-to-day work. You no longer need to be an expert to exploit the full potential of the structural interactome and pocketome.

SOLUTION PROVIDER PRESENTATION:LAURENCE PAINELLVP Marketing, IDBSInformatics landscape trends for R&D in the next 10 years – what is happening now and what should we expect as scientist and data scientist

• What are the emerging sciences and demands that is putting on informatics providers – science is now asking much more than was thought possible just 10 years ago

• What are the cloud and new technologies that are already changing the way we think about data in R&D – supporting the near term science trends but ensuring longevity

• The Changing face of science workflow and the impacts on “security”, data transfer, communication and reporting – what we think things look like and what actually happens in the real world

Afternoon Refreshments / Poster Presentations / One-to-One Meetings15:30-16:20

COMPLEX DATA ANALYTICS AND METHOD DEVELOPMENT SYSTEM INTEGRATION AND WORKFLOW OPTIMISATION

TRACK CHAIR: EDDY VANDE WATERS, Senior Director, BIOVIA Field Applications

TRACK CHAIR: ARIE BAAK, Co-Founder, Euretos

ALEX ARONOVHead of Global Research Informatics, Vertex PharmaceuticalsDiscovery Informatics Toolkit – Discovering Relationships between Targets and Small Molecules

We study emerging networks at the interface of drugs, their underlying mechanisms of action, and the phenotypes that result from drug action. These phenotypes can be desired, such as reversal of disease pathology, or undesired, such as drug side effects. Three select topics will be discussed: 1) tools for bioactivity prediction to bridge chemical and biological space, along with their use cases; 2) incorporating bioactivity information to improve screening collections; and 3) evaluation of drug discovery effectiveness through the lens of mechanism-indication pairs.

Track 1: Londres A&B Track 2: Madrid A

GLOBAL PHARMA R&D INFORMATICS CONGRESS 2017

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Chair's Closing Remarks / End of Day One17:35

Networking Drinks Reception17:35-18:35

CONGRESS SCHEDULE DAY 1 THURSDAY 30TH NOVEMBER 2017

JAY BERGERONDirector of Translational and Bioinformatics, PfizereTRIKS: Successes, Surprises and Lessons on the Verge of Completing the Largest General Translational Informatics Public Private Partnership to Date

• eTRIKS is a 5 year IMI project to provide a translational informatics products and services to other IMI programs and Eu PPPs

• eTRIKS served over 60 projects during its tenure• eTRIKS created a tranSMART-based platform that is fully

open source

ROUNDTABLE DISCUSSIONS:

1) Data standardisation within smart lab systemsDANIEL JUCHLICTO, Standardization in Lab Automation (SiLA)BURKHARD SCHAEFERPresident, BSSN Software GmbH

2) Virtual compound modellingFRIEDRICH RIPPMANNDirector of Computational Chemistry and Biology, Merck KGaA

3) Integrating systems to improve user interfacesDIMITAR HRISTOZOVTeam Leader, Research Informatics, Evotec

4) Leveraging IoT in the LabDANIELA JANSENDirector of Solution Marketing, Dassault Systèmes BIOVIA

*Full details can be found at the end of the congress schedule section

16:20-17:10

DEREK MARRENDirector of IT, Eli Lilly and CompanyWhat you are never told about Public –Private Consortia and Pre-competitive Engagements: so just how do they work and why should you care

There are many philanthropic reasons for collaborations and we hear many statements from those who say that pre- competitive collaborations are a way of providing value to the members with the combined focus of vision and common goals, spreading the risk and getting more for the monetary investment With examples of real success stories and those which leave us with nightmares, why do we continue to do it, and what have we learned from the various forms of these pre-competitive ventures... Is there real Gold at the end of this pre-competitive rainbow, in this presentation I will share my experiences in this arena.

16:45-17:1016:20-16:45

17:10-17:35

SOPHIA ANANIADOUDirector, National Centre for Text Mining and Professor of Computer Science, University of Manchester, UKMachine reading for cancer biologyText mining extracts complex information from text (entities, events and epistemic knowledge). To support pathway construction and the design of experiments we extract evidence from literature, bridging the gap between knowledge and text. Deep machine reading supports the understanding of cancer mechanisms. Epistemic knowledge supports

the detection of uncertainty and discovery of new knowledge. Interoperable text mining platforms (e.g. Argo) allow the straightforward integration of text mining tools and the development of modular, extensible and reusable text mining workflows.

COMPLEX DATA ANALYTICS AND METHOD DEVELOPMENT SYSTEM INTEGRATION AND WORKFLOW OPTIMISATION

Track 1: Londres A&B Track 2: Madrid A

GLOBAL PHARMA R&D INFORMATICS CONGRESS 2017

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CONGRESS SCHEDULE DAY 2 FRIDAY 1ST DECEMBER 2017

Refreshments08:20-08:55

Morning Refreshments / One-to-One Meetings10:40-11:50

COMPLEX DATA ANALYTICS AND METHOD DEVELOPMENT AI AND MACHINE LEARNING

09:00-09:4010:10-10:40

11:50-12:15

11:50-12:15

KEYNOTE ADDRESS:BRANDON ALLGOODCTO and Co-Founder, Numerate IncAI in drug discovery: Current state and opportunities• Review the state of AI currently being applied to drug discovery through case studies: both biology forward and clinic backward• Examine some of the challenges with AI, such as, explainability vs predictability and handling noise and bias• Explore the future of AI in drug discovery

09:40-10:10

SOLUTION PROVIDER PRESENTATION:ARIE BAAKCo-founder, EuretosIn-silico identification & validation of targets and biomarkers for the casual IT userLife sciences research is increasingly relying on big data analytics to drive scientific discovery. The majority of researchers are, however, casual users of IT and need the support of highly skilled data experts and bioinformaticians

to benefit from these technologies. The Euretos platform bridges this divide and puts the power of bioinformatics and big data analytics directly in the hands of biologists and researchers. Achieving this requires an approach that fundamentally matches the needs, interests and abilities of this type of user.The presentation will cover the following themes:• The life sciences researcher as casual user of IT• Integrating in-silico with in-vitro and in-vivo research• Organising knowledge for life sciences research• Artificial Intelligence and NLP• Case studies

KEYNOTE ADDRESS:MARGRET ASSFALGGlobal Head, Research Informatics and Discovery Workflows, Roche, SwitzerlandIntroduction of a knowledge system in Discovery spanning processes and data analysis across several therapeutic modalitiesThe talk will describe the design, implementation, and introduction of a process and knowledge management system

in Discovery research at Roche. The described system spans across 3 therapeutic modalities; small molecules, protein therapeutics, and RNA therapeutics.

OLIVER KOCHGroup Leader, Medicinal Chemistry, Technical University of Dortmund, GermanyA medicinal chemistry guide to binding site comparisonThe growing number of published protein

structures and the vast amount of software to detect binding site similarities allow a fast and user-friendly comparison of thousands of protein pockets. The identification of binding site similarities can have an impact on binding site identification, function annotation, polypharmacology, off-target prediction, and drug repurposing [1]. Nevertheless, the choice of a suitable tool, for example, to compare a binding site of interest to various known binding sites is still a difficult task. Based on an exhaustive evaluation it becomes obvious that the choice highly depends on the aim of the study. This presentation will focus on different applications and present a detailed guide to binding site comparison.

WILLEM VAN HOORNHead of ChemoInformatics, ExscientiaScaling de novo design, from single target to disease portfolioAn overview is given of the technology that Exscientia applies to automatically design

patentable compounds and how this technology has been successfully used in collaborations designing compounds for single protein targets as well as target combinations. Finally it is shown how scaling the technology enabled designing compounds against a matrix of disease-related targets.

TRACK CHAIR: BRANDON ALLGOOD, CTO and Co-Founder, Numerate Inc

TRACK CHAIR: MARTIN SJÖHOLM, Senior Architect, Computational Life Science IT, Bayer

Room: Viena

08:55-09:00 Track Chair's Opening Remarks: Martin Sjöholm, Senior Architect, Computational Life Science IT, Bayer

Track 1: Londres A&B Track 2: Madrid A

Room: Viena

GLOBAL PHARMA R&D INFORMATICS CONGRESS 2017

Track 1: Londres A&B

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CONGRESS SCHEDULE DAY 2 FRIDAY 1ST DECEMBER 2017

MICHAL FOJTAKResearch Consultant, Biology Results & Neuroscience IT, Eli Lilly and CompanyAnimal behavior detection from experiment videosA tale of how we implemented Deep Learning

approach for detection and classification of spatio-temporal activities in video signals.• Evaluation of supervised learning models• Neural Network Training and inference at scale – findings and

observations on our way towards GPU cluster

12:15-12:40

12:15-12:40

12:40-13:0013:00-13:20

SOLUTION PROVIDER PRESENTATION:IRINA EFIMENKOFounder and CEO, Semantic HubSemantic Technologies in Pharma: How Not to Miss Your Next BlockbusterSemantic Hub helps the Experts of R&D Semantic Hub helps R&D experts accelerate the identification of promising developments (for example, new targets, novel molecules, combinations, delivery systems). In Pharma, there are always high risks. R&D experts have to analyze

huge amounts of information in order to get “the funnel” of promising candidates or to qualify the specific investment target.Semantic Hub service is based on natural language processing and AI approaches. It provides: ‒ Scanning Internet and databases, and “reading” millions of documents; ‒ Semantic analysis of relevant scientific papers, conference posters, clinical trial results, patents, news, etc.; ‒ Generation of insights on all the important factors and customers’ criteria.It accelerates the search, qualification, and evaluation of candidates. Thus, an expert is able to analyze 1000 candidates instead of 10.

JENNIFER RUSSO WORTMAN Senior Director, Bioinformatics, Seres Therapeutics, USAUnravelling microbiome signatures for drug designSeres Therapeutics is a clinical-stage company

with the mission to transform the lives of patients worldwide with revolutionary microbiome therapeutics. Our proprietary reverse translation discovery and design platform enables us to identify key alterations in the microbiome that are associated with or lead to specific diseases, and to rationally design tailored therapies that disrupt the disease state and may establish a healthy microbiome. There are myriad technical challenges to be overcome transitioning a microbiome therapeutic through the drug discovery pipeline. Seres is well positioned to tackle these challenges leveraging our discovery informatics capabilities, extensive strain library and demonstrated ability to translate microbiome candidates into clinical trials.

SOLUTION PROVIDER PRESENTATION:GUY DESMARQUETSDirector of Strategy and Business Development, Software Solutions and Informatics Services, BrukerImproving NMR data quality, consistency and standardization for better decision-making support and improved mining of stored analytical information.Summary: The quantitative nature of NMR makes it a very efficient choice over other analytical techniques such as

LC-MS, but for decades the technology has been perceived as complex and a tool for experts. Today’s NMR is easier to use and to further expand its accessibility, Bruker has developed an informatics environment which includes automated performance validation and experiment optimization at the spectrometer level. Additional enhancements include expert-systems providing results in full automation, integration of the applications into third parties software such as ELN or LIMS, conversion into universal format for efficient mining, tools and SOPs for GxP, 21CFRp11, QbD compliance and more.

Lunch13:20-14:20

14:20-14:45

PANEL DISCUSSION:The Current Challenges of Data Security and Regulation for the Pharmaceutical Industry

This panel session will discuss data security and IP protection challenges particularly when sharing data with outsourcing partners, between departments, and with other companies in pre-competitive partnerships.

JAMES WILLANS (Chair)Chief Technology Officer, Lhasa Limited

BRANDON ALLGOODCTO and Co-Founder, Numerate Inc

14:20-15:10

JEREMY EDMUNDSDirector of Immunology Chemistry, AbbVieMeasuring project success and Shannon's maxim: the enemy knows the systemDiscovery projects often require long periods of time and large amount of resources to proceed

from an exploratory phase to clinical candidate generation. It is common for hundreds or thousands of compounds to be generated over the course of several years by project teams pursuing multiple lead series, often while facing many roadblocks along the way. Frequently one is left to wonder whether projects should continue or whether additional optimisation efforts are futile. This talk will illustrate an objective tractability approach retrospectively applied within Abbvie Immunology for projects achieving clinical candidates and those curtailed in the lead optimization phase.

Room: Viena

COMPLEX DATA ANALYTICS AND METHOD DEVELOPMENT DATA STORAGE AND MANAGEMENT

TRACK CHAIR: JOHN DAVIS, Lead Scientist, Operational Technology and Informatics, Lonza Biologics

TRACK CHAIR: MARTIN SJÖHOLM, Senior Architect, Computational Life Science IT, Bayer

Track 1: Londres A&B Track 2: Madrid A

GLOBAL PHARMA R&D INFORMATICS CONGRESS 2017

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CONGRESS SCHEDULE

15:10-15:35

JAMES WILLANSChief Technology Officer, Lhasa LimitedObservations on the pharma’s industry convergence toward cloudLhasa’s members include over two hundred pharma organisations including nineteen of

the largest top twenty. Lhasa regular engages with its member organisations to understand how we can better support their needs. Recently we have consulted a group of members to discuss their adoption of cloud, from this study a number of trends were observed. In this talk we will discuss these trends and other observations we have made based on follow-up conversations.

15:10-15:35

BIN CHENAssistant Professor, University of California San Francisco, USACan data scientists lead the discovery of therapeutic in cancer?Rapidly decreasing costs of molecular

measurement technologies not only enable profiling of disease sample molecular features at different levels (e.g., transcriptome, proteome, metabolome) but also enable measuring of cellular signatures of individual drugs in clinically relevant models. Exploring systematic approaches to find drugs for diseases through various molecular features is important in the discovery of new therapeutics. We propose a systems-approach to identifying drugs that reverse the molecular state of a disease. We used this approach to discover drug candidates for hepatocellular carcinoma and Ewing's sarcoma. In this talk, I will talk about this systems-approach and share how a data scientist led the discovery of new therapeutic candidates for liver cancer.

14:45-15:10

ARNAUD SARTREGlobal Laboratory Informatics Senior Manager, PfizerTransforming our scientific data paradigmThis talk will take the audience from a typical pharmaceutical development laboratory to one

driven by greater data insights. Through the use of cloud and big data technologies, we will explore how to generate greater value and insight from data generated across a wide variety of disciplines. The talk will finally discuss how novel approaches to the capture, use and re-use of data can accelerate the creation of new knowledge for our scientists.

MARGRET ASSFALGGlobal Head, Research Informatics and Discovery Workflows, Roche

JAY BERGERONDirector of Translational and Bioinformatics, Pfizer

14:25-15:10

JAMES LUMLEYSenior Scientist, Informatics, Eli Lilly and CompanyTransforming Large Pharma Bioactivity data stores into Knowledge SystemsA greater number of large bioactivity datasets

has created a unique data analytics opportunity in drug discovery but has not yet led to quantifiable cost savings. The Matched Pairs and Series methods offer high quality suggestions of 'what to make next' rooted in accessible chemistry. Chemical space (possible compounds) and transform space (possible changes made to a compound) far exceed the knowledge in existing datasets. Metrics derived to define high quality rules from a dataset to guide optimisation highlight these limitations. Methods such as graph interpolation and predicting matched pair deltas offer some help to expand knowledge and accelerate compound progression. The confluence of these and other new methods with high quality retrosynthesis and automated synthesis offers the possibility for faster, targeted molecule design cycles.

15:35-16:00

JENNIFER HEYMONTSenior Data Scientist, Eisai AiMWhen automation can't keep bad data out: strategies for identifying, cleaning, and living with dirtEnterprise databases are a valuable resource, but the data needs to be stored ready-for-use

without the need for extensive cleaning before analysis. We'll discuss the major entry points for unclean data, together with strategies to bar the doorways and rectify bad data that has already come in.

15:35-16:00

Conference Close16:00

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POSTER PRESENTATIONS

MAKING A POSTER PRESENTATION

Poster presentation sessions will take place in breaks and alongside the other breakout sessions of the conference. Your presentation will be displayed in a dedicated area, with the other accepted posters from industry and academic presenters. We also issue a poster eBook to all attendees with your full abstract in and can share your poster as a PDF after the meeting if you desire (optional). Whether looking for funding, employment opportunities or simply wanting to share your work with a like-minded and focused group, these are an excellent way to join the heart of this congress.

In order to present a poster at the congress you need to be registered as a delegate. Please note that there is limited space available and poster space is assigned on a first come first served basis (subject to checks and successful registration). We charge an admin fee of €100 to industry delegates to present, that goes towards the shared cost of providing the poster presentation area and display boards, guides etc. This fee is waived for those representing academic institutions and not for profit organisations.

CONGRESS SCHEDULE

ROUNDTABLE DISCUSSIONS:

1 Data Standardisation Within Smart LabsDANIEL JUCHLI

CTO, Standardization in Lab Automation (SiLA), SwitzerlandBURKHARD SCHAEFERPresident, BSSN Software GmbH• Introduction to SiLA – Standards in Laboratory Automation –

The New SiLA 2 Framework For Lab Automation and AnIML – Analytical Information Markup Language

• How to employ Internet of Things (IoT) and Industry 4.0 Concepts in Smart Labs

• SiLA compared to other standards and organizations like Pistoia, OPC Foundation, Allotrope Foundation

2 Virtual Compound ModellingFRIEDRICH RIPPMANN

Director of Computational Chemistry and Biology, Merck KGaA, Germany• Large-scale virtual libraries: how to generate and use them?• How to assess impact?• Integrated IT from compound idea to synthesised and tested

compound

3 Integrating Systems to Improve User InterfacesDIMITAR HRISTOZOV

Team Leader, Research Informatics, Evotec, UK• Bringing computational tools to the scientist’s work bench – is

the web browser the operating system of the 21st century? • Workflow management suites as a software integration platform• Drug discovery on the go - should computational tools go mobile?• Interfacing open source software - approaches to and

challenges with leveraging the work of the community

4 Leveraging IoT in the LabDANIELA JANSEN

Director of Solution Marketing, Dassault Systèmes BIOVIANew technologies allows the industry to connect a plethora of different new devices and go beyond simple integration of lab equipment. The Internet of Things (IoT) can have a deep impact on data collection, data integration and collaboration in the lab in research, development and quality. In this round table we will discuss the requirement for IoT in the lab, (potential) value and outcomes, experiences and lessons learned as well as the impact it can have on the lab and on the larger organization.

*Full details of the Roundtable Discussions at 16:20

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CONGRESS SCHEDULE

SANA Metropolitan HotelR. Soeiro Pereira Gomes, Parcela 21600-198 Lisbon, Portugal

With a spacious, contemporary decor, the SANA Metropolitan is a cosmopolitan hotel which offers special comfort for both leisure and business trips to the city. And since it's located close to major roads, it's the perfect choice for people who want to get into or out of the city, and at the same time reach the centre of Lisbon.www.metropolitan.sanahotels.com

For more information, please contact Scott Taylor at: [email protected]

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