These are the slides for the October 15, 2013 webinar.

1. INTRODUCTION TO
REAXYS
Webinar presented October 15, 2013
Christine Flemming
Elsevier Product Training Manager
October 15, 2013

2. Look for the slides and
webinar recordings on
SlideShare and YouTube

3. AGENDA
• INTRODUCTION
• THE REAXYS CHEMISTRY
DISCOVERY ENGINE
• DEMO
• QUESTIONS

4. •
The workflow solutions that leading chemists prefer to use
• 95% of the largest pharmaceutical R&D organizations and
70 of the top 100 chemistry universities have already
chosen Reaxys
•
Powerful solutions across the
entire chemistry workflow
• Designed by chemists to help chemists of all kinds in
all sectors, advance more quickly and confidently
through their research

5. PART OF LIFE SCIENCE SOLUTIONS
SERVING THE WHOLE LIFE SCIENCES COMMUNITY
ACADEMIA & GOVERNMENT
CORPORATE
Academic Researchers
Principal Investigators
Pharmacologists
Medical Researchers
Regulatory Affairs
Clinical/Medical Researchers
Molecular Biologists
Bio-informaticians
Chemists
Chem-informaticians
Safety Phamacologists
Phamacokineticists
Regulatory Affairs
Clinical Researchers
Medical Affairs
Pharmacovigilance

6. PART OF LIFE SCIENCE SOLUTIONS
A SUITE OF INTEROPERABLE, DOMAIN-SPECIFIC, DECISION SUPPORT TOOLS
TARGETINSIGHTS
REAXYS
PATHWAY STUDIO
PHARMAPENDIUM
REAXYS MEDICINAL CHEMISTRY
EMBASE
QUOSA

7. SUITE OF DECISION SUPPORT TOOLS
ADDRESSING KEY USE CASES
Understand
Pathways/MoA
Find and characterise
targets
DISCOVERY
7
Characterize and
discover molecules
Identify, optimize and
prioritize compounds
PRE-CLINICAL
Learn/act on preclinical &clinical data
(translational)
CLINICAL
Post market
tracking,
Pharmacovigilance
POST LAUNCH
Professional Services
Extract value from R&D data through custom services
Organize and manage
scientific literature

8. THE REAXYS CHEMISTRY
DISCOVERY ENGINE
KEY FEATURES

9. SUPPORTS ENTIRE WORKFLOW
ANSWERING YOUR QUESTIONS AT EVERY
STAGE OF YOUR RESEARCH WORKFLOW
Some of the key questions that Reaxys
will help answer:
•
•
•
•
•
•
Does a compound exist?
What is known about the compound?
Is this compound commercially available?
How to synthesize this compound?
What is known about this area of research?
Who else is working on this compound or reaction
type?
Reaxys gives relevant and actionable answers and
allows you to move your research forward.
UNDERSTAND
Know and understand what
others have done and how.
Access the relevant and
actionable information quickly
with a dedicated solution.
Discover information
you didn’t
realize you were
missing.
REPORT &
COMMUNICATE
Share results with your peers.
Gain insight and move on to new
projects with confidence.
Accelerate innovation
and research progress.
EXPERIMENT
Design experiments
without wasting time.
Get existing compounds or find
out how to synthesize them.
Use experimentally measured
data to move your research
forward more quickly.

10. WHAT ARE SOME OTHER QUESTIONS REAXYS CAN ANSWER?
“How can I find reactions where an aryl halide
has been transformed into an aryl ketone?”
“How can I search for superconducting
substances containing Barium, Yttrium, and
Copper?”
“How can I get pharmacokinetic data (Cmax or
AUC) for substances with this substructure that
have undergone preclinical or clinical evaluation?”
“I have a list of natural products and I’d like to
know if any of them contain antimalarial activity.
How can I do this in Reaxys?”
10

11. A UNIVERSE OF CHEMISTRY INFORMATION
REAXYS 2013
NOW REAXYS SOURCES RELEVANT CHEMISTRY INFORMATION FROM ADJACENT
SCIENTIFIC FIELDS, BRINGING THEM WITHIN REACH OF THE CHEMISTRY RESEARCHER
15,973 PERIODICALS COVERING
CHEMISTRY
• AGRICULTURAL AND
BIOLOGICAL SCIENCES
• 400 CORE JOURNALS
• RELEVANT CHEMISTRY
PATENTS
• HISTORICAL CHEMISTRY
DATA (FROM 1771)
• BIOCHEMISTRY, GENETICS
AND MOLECULAR BIOLOGY
• CHEMICAL ENGINEERING
• CHEMISTRY
CHEMISTRY
RESEARCHER
• DENTISTRY
• EARTH AND PLANETARY SCIENCES
• ENERGY
• ENGINEERING
• ENVIRONMENTAL SCIENCE
• IMMUNOLOGY AND MICROBIOLOGY
• MATERIALS SCIENCE
Extract title and abstract enabling
researchers to do extended
bibliographic search across all
scientific domains. Providing
access to journals you wouldn’t
consider searching for.
• MEDICINE
• NEUROSCIENCE
• PHARMACOLOGY, TOXICOLOGY
AND PHARMACEUTICS
Facts
• PHYSICS AND ASTRONOMY
• VETERINARY
Facts
Facts

12. HOME PAGE:
MANY WAYS TO ASK YOUR QUESTIONS
UNDERSTAND
REPORT &
COMMUNICATE
EXPERIMENT
Data search
form
by subject
Open a
structure
search form
Search using
chemical
identifiers
Perform a
literature
search

13. AUTOPLAN:
AUTOMATES THE UNDERLYING PROCESSES IN CREATING SYNTHESIS ROUTES
UNDERSTAND
REPORT &
COMMUNICATE
EXPERIMENT

14. FIND MULTIPLE SYNTHESIS ROUTES TO THE NATURAL
PRODUCT SHIKONIN

15. 15

16. ANALYSIS VIEW:
POWERFUL FILTER TO FIND WHAT YOU WANT IN JUST A FEW CLICKS
UNDERSTAND
REPORT &
COMMUNICATE
EXPERIMENT

17. ANALYSIS

21. REPORTING:
GATHER AND PREPARE THE INFORMATION
UNDERSTAND
REPORT &
COMMUNICATE
EXPERIMENT

22. REPORTING:
SHARE THE INFORMATION
UNDERSTAND
REPORT &
COMMUNICATE
EXPERIMENT

23. CREATE A REPORT
23

29. INTEGRATED. JUST HOW YOU LIKE IT
IN-HOUSE DATA:
REAXYS APIs:
Seamless integration
for maximized search
efficiency
Combine the quality
data you get from
Reaxys with in-house
creativity to build
new solutions tailormade for your specific
research interests
PUBCHEM:
Includes biochem. &
pharmaco information
COMMERCIAL
AVAILABILITY:
Data and purchasing
possibilities
ELECTRONIC LAB
NOTEBOOKS:
Improve collaboration,
minimize errors,
save time
REAXYS STRUCTURE
FLAT FILE:
Incorporate
information into data
mining and internal
search systems

30. DEMO

31. REACTION SEARCHING
Find one-pot synthesis of spiro-oxindoles
1
2

32. FIND ONE-POT SYNTHESIS OF SPIRO-OXINDOLES: RESULTS

33. PATENTS
I would like to find patents containing information on the
oxidative cleavage of c-c bonds (like those found in styrene)
into carboxylic acids using manganese-containing catalysts.
Then I want to export the list in a PDF:
Reaction example:
Generalize
the query

34. 245 reactions, like these, are retrieved:
Which ones Use “Analysis View” to limit the catalysts?
use manganese-containing
list to 79 reactions with
manganese-containing catalysts.
What type of reactions are they?

35. Which Patent Assignees show up
most frequently in this list of 79
reactions?
Who received patents with this
type of reaction between 2000 –
2008?

36. Limit the list to
rections found in
patents
And then export
the list in various
formats,
such as
PDF.

37. SUBSTANCE SEARCHING
Finding a list of substances with the same biological activity
Find natural products
with antimalarial activity
37

38. THANK YOU
ANY QUESTIONS?
Next webinar:
Tomorrow, Oct. 16, 2013
Reaxys Medicinal Chemistry
10:00 AM – 10:45 AM EDT
Registration link:
https://www3.gotomeeting.com/register/614421950
Please complete the survey that
appears at the end of this webinar
Thank you!