SEURAT Structure Exploration Utility for RAtional Therapeutics Chem

SEURAT Structure Exploration Utility for RAtional Therapeutics Chem. Axon US UGM– September 2009

What is SEURAT? Product Overview Structure Exploration Utility for Rational Therapeutics ◦ Rich Internet Application (RIA) Optimized specifically for small molecule screening, hit-to-lead and lead optimization Extract full discovery value from in-house and in-licensed DB’s and tools ◦ Directly access existing corporate, 3 rd party, patent and lit DB’s & meta-information. ◦ Open System: Incorporate 3 rd & in-house computational tools easily. ◦ Perform & track SAR analyses. ◦ Visual Data Mining: Create & track hypotheses. ◦ Easy for bench scientists to use. 4 June 2009 2

What is SEURAT? Who is it for, what problem does it solve? chemists, biologists and preclinical scientists who struggle daily to extract full discovery value from a broad mixture of in-house and in-licensed data sources and tools. SEURAT is a drug discovery Rich Internet Application that delivers flexible knowledge capture, access, reporting and collaboration without creating a new data silo, database or data container. Unlike general purpose data workflow and pipelining platforms SEURAT is optimized specifically for small molecule screening, hit-to-lead and lead optimization. 3

A problem SEURAT can help solve? 3000 hits 10 series Singleton s Credit: Yvonne Martin And Derek Debe Overall Toxicity Molecular properties IP position SAR available/easy Selectivity Follow on assays Purity & identity Potency # analogues Elevating a Hit to a Lead Pass More data requested Fail

A problem SEURAT can help solve? Credit: Yvonne Martin And Project must initiate & track… Derek Debe 3000 + 20 + 1500 requests for additional testing 30, 000 pieces of database information on the hits 240 individual database searches to compose, execute, evaluate and track, 60 compounds to order, track, register, and submit for testing 30, 000 molecular properties to calculate or look up A few clustering runs 40 computational toxicity predictions made 10 different computer programs used http: //www. synapticscience. com/acs-09/Debe_ACS_2009. pdf

Historically diverse set of tools Few in project master the whole set 4 June 2009 http: //www. synapticscience. com/acs-09/Debe_ACS_2009. pdf 6

SEURAT : A Single Integrated RIA More of the project team can master 4 June 2009 http: //www. synapticscience. com/acs-09/Debe_ACS_2009. pdf 7

SEURAT Proven Product with Clear ROI In the customers’ own words… Compressed Time between Data Collection, Decision, & Reporting ◦ Enhanced Decision Clarity, Transparency, and Consensus Building ◦ “Seurat provides …project teams an effective environment to quickly assess the quality of multiple compounds based on multiple parameters. … leads to more effective decision making regarding what to synthesize next, the greatest value lies in its potential to alleviate the time and resources that can be wasted “over-perfecting” a compound series. ” Increased Individual Innovation via Deriving New Insights from the Data ◦ Seurat is enabling scientists to quickly and easily create decision-enabling reports from …Discovery data. A critical feature is SEURAT’s ability to report and re-report both comprehensive and time-delineated updates. “Seurat is enabling scientists to analyze compound data in ways that have not been possible with our legacy toolset (including Spot. Fire). ” Increased Organizational Innovation via Increasing the Number of Capable Users ◦ “…By reducing the environment complexity, Seurat has increased the number of users that can successfully utilize experimental data to its fullest capacity , which in turn increases the probability that new innovations and insights will be gained. ” 4 June 2009 8

Core SEURAT 4 June 2009 9

SEURAT Easily build Live Reports An assay value out of context looses meaning. Don’t try to coerce data into a single form Biological Assays ◦ Imprecise values shown and can be used in calculations ◦ Aggregate experiments per compound mouse over for detail Pharmacokinetics & Pharmacology ◦ Confidence Intervals ◦ Link to full report when available 4 June 2009 10

SEURAT Easily build Live Reports Don’t force user to articulate thesis to start, instead let the user organically grow analysis steps as needed Start with a simple query Incremental complexity – add, remove data as needed in steps Record script for replay – save it for later, email to others Real-time data acquisition – always see the latest results 4 June 2009 11

SEURAT Make new discoveries about your data – SAR Alternate but linked views of results: ◦ Tabular and most familiar ◦ Matrix view with zooming and cell coloring for emphasis of “hot spots” Can still organically grow the tabular view to better inform the matrix view 4 June 2009 12

SEURAT Easy to adopt promoting greater collaboration Kinome browser Real Time Interactive Property Prediction Crystal Structures 4 June 2009 13

SEURAT Easy to adopt promoting greater collaboration Patent landscape browser PK Reports Available chemicals directory 4 June 2009 14

SEURAT Visualization Easy to use Analytics 4 June 2009 15

Rich Internet Application SEURAT reports in Sharepoint™ / Website 4 June 2009 16

Hosted SEURAT Multi-Site Collaboration 4 June 2009 17

Hosted SEURAT CRO Collaboration 4 June 2009 18

SEURAT Contact us info@synapticscience. com +1 301 915 0274 www. synapticscience. com Remember: ◦ We offer free 30 day evaluations of the SEURAT platform. ◦ We can get SEURAT setup to access your existing database(s) at no additional charge and without the need to migrate any data. 4 June 2009 19