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T H E K N O W L E D G E G R A P H
Join our community at grakn.ai/community
Using Grakn in Protein
Sequence Alignment
By Tomas Sabat
COO of GRAKN.AI
@graknlabs
@tasabat
Follow us @GraknLabs
We push the boundary of intelligent systems forward,
starting at the database.
Follow us @GraknLabs
Integrating datasets Contextualisation of insights Discovery of new relationships
Difficult to integrate heterogeneous
and flat datasets
Difficult to ingest insights and
connect with rest of public/private
data
Difficult to reason and discover
new explainable relationships
What problems have we found in bioinformatics?
Follow us @GraknLabs
Grakn accelerates biomedical knowledge discovery
Faster ingestion and integration
of data
Contextualise newly generated
insights
Discover and explain new
relationships
Grakn’s hyper-relational data model
enables fast and flexible integration of
heterogeneous biomedical data sets
Bring context to newly generated
insights by understanding how it
interacts with the rest of the graph
Through automated deductive
reasoning of data points derive new
relationships between biological
components
Follow us @GraknLabs
GRAKN.AI the knowledge base
foundation for intelligent systems
a.k.a.,
GRAKN.AI is a knowledge graph
Knowledge Storage System
Novel Knowledge Representation System based on
Hypergraph Theory
Knowledge Inference
OLTP Reasoning Engine
Knowledge Analytics
OLAP Distributed Analytics
Follow us @GraknLabs
1. How do we integrate biomedical data?
Follow us @GraknLabs
Integrating data
Protein
Follow us @GraknLabs
Integrating data
Protein
Kinase
sub
Ion
-channel
Nuclear-
receptor GPCR
sub sub sub
Follow us @GraknLabs
Integrating data
Drug
Disease
Protein
Gene
Kinase
sub
Ion
-channel
Nuclear-
receptor GPCR
sub sub sub
Follow us @GraknLabs
Integrating data
Drug
Disease
Protein
Gene
gene-
protein-
encoding
encoding-gene
encoded-protein
Kinase
sub
Ion
-channel
Nuclear-
receptor GPCR
sub sub sub
Follow us @GraknLabs
Integrating data
Protein
Drug
DiseaseGene
encoding-gene
encoded-protein
protein-
disease-
associati
on
associated-protein
associated-disease
associated-diseaseassociated-gene
drug-
protein-
interaction
target-protein
interacted-drug
drug-gene-
interaction
inhibitor
target-gene
drug--
disease-
association
affected-disease
therapeutic
gene-
protein-
encoding
gene-
disease-
association
Kinase
sub
Ion
-channel
Nuclear-
receptor GPCR
sub sub sub
Follow us @GraknLabs
Hyper-Relationship Example: Nested-Relationship
Protein Protein
Tissue
PPI
loc
interacting interacting
data source
has
Follow us @GraknLabs
Hyper-Relationship Example: Ternary-Relationship
Drug
Disease
Side
effect
therapeutic
effect
ass
Follow us @GraknLabs
2. How do we ingest and contextualise sequencing data?
Follow us @GraknLabs
How do we ingest and contextualise sequencing data?
Protein
Drug
Disease
Gene
encoding-gene
encoded-protein
protein-
disease-
associati
on
associated-
protein
associated-disease
associated-disease
associated-gene
drug-
protein-
interaction
target-protein
interacted-drug
drug-gene-
interaction
inhibitor
target-gene
drug-
disease-
association
affected-disease
therapeutic
gene-
protein-
encoding
gene-
disease-
association
Kinase
sub
Ion
-channel
Nuclear-
receptor GPCR
sub sub sub
Follow us @GraknLabs
How do we ingest and contextualise sequencing data?
Protein
Drug
Disease
Gene
protein-
protein-
alignment
target-protein
matched-protein
encoding-gene
encoded-protein
protein-
disease-
associati
on
associated-
protein
associated-disease
associated-disease
associated-gene
drug-
protein-
interaction
target-protein
interacted-drug
drug-gene-
interaction
inhibitor
target-gene
drug-
disease-
association
affected-disease
therapeutic
gene-
protein-
encoding
gene-
disease-
association
sequence
Kinase
sub
Ion
-channel
Nuclear-
receptor GPCR
sub sub sub
Follow us @GraknLabs
How do we ingest and contextualise sequencing data?
Protein
Drug
Disease
Gene
protein-
protein-
alignment
target-protein
matched-protein
encoding-gene
encoded-protein
protein-
disease-
associati
on
associated-
protein
associated-disease
associated-disease
associated-gene
drug-
protein-
interaction
target-protein
interacted-drug
drug-gene-
interaction
inhibitor
target-gene
drug-
disease-
association
affected-disease
therapeutic
gene-
protein-
encoding
gene-
disease-
association
sequenceSequence-
sequence-
alignment
target-seq
matched-seq
Kinase
sub
Ion
-channel
Nuclear-
receptor GPCR
sub sub sub
Follow us @GraknLabs
How do we ingest and contextualise sequencing data?
Protein
Drug
Disease
Gene
protein-
protein-
alignment
target-protein
matched-protein
encoding-gene
encoded-protein
protein-
disease-
associati
on
associated-
protein
associated-disease
associated-disease
associated-gene
drug-
protein-
interaction
target-protein
interacted-drug
drug-gene-
interaction
inhibitor
target-gene
drug-
disease-
association
affected-disease
therapeutic
gene-
protein-
encoding
gene-
disease-
association
sequenceSequence-
sequence-
alignment
target-seq
matched-seq
sequence-
positivity
sequence-
identicality
Kinase
sub
Ion
-channel
Nuclear-
receptor GPCR
sub sub sub
Follow us @GraknLabs
3. How do we discover and explain new relationships?
Follow us @GraknLabs
How do we discover new relationships?
Protein
Drug
Disease
Gene
protein-
protein-
alignment
target-protein
matched-protein
encoding-gene
encoded-protein
protein-
disease-
associati
on
associated-
protein
associated-disease
associated-disease
associated-gene
drug-
protein-
interaction
target-protein
interacted-drug
drug-gene-
interaction
inhibitor
target-gene
drug-
disease-
association
affected-disease
therapeutic
gene-
protein-
encoding
gene-
disease-
association
sequenceSequence-
sequence-
alignment
target-seq
matched-seq
sequence-
positivity
sequence-
identicality
Kinase
sub
Ion
-channel
Nuclear-
receptor GPCR
sub sub sub
Follow us @GraknLabs
Complex Query Example
Asthma
Disease
Gene
Nuclear
Receptor
Kinase
Ion
channel
GPCR
Nuclear
Receptor
Kinase
Ion
channel
GPCR Gene
Drug
seq seq
seq seq
seq seq
seq seq
ass
ass
ass
ass
ass
ass
ass
ass
enc
enc enc
enc
What drugs are associated to “Asthma”?
align
id
pos
Follow us @GraknLabs
align
Complex Query Example
Asthma
Disease
Gene
Nuclear
Receptor
Kinase
Ion
channel
GPCR
Nuclear
Receptor
Kinase
Ion
channel
GPCR Gene
Drug
seq seq
align
seq seq
seq seq
seq seq
ass
ass
ass
ass
ass
ass
ass
ass
enc
enc enc
enc
What drugs are associated to “Asthma”?
id
pos
Follow us @GraknLabs
Rule Example: Transitive Relationship
Protein Protein
align
Drug
ass
ass
Disease
ass
Follow us @GraknLabs
Rule Example: Transitive Relationship
Protein Protein
align
Drug
ass
ass
Disease
ass
Follow us @GraknLabs
Rule Example: Chained Rules
Protein
sequence-
alignment
Protein
sequence sequence
protein-
alignment
seq-pos seq-id
>0.9 >0.9
Follow us @GraknLabs
Rule Example: Chained Rules
Protein
sequence-
alignment
Protein
sequence sequence
protein-
alignment
seq-pos seq-id
>0.9 >0.9
Follow us @GraknLabs
1. How do we integrate so much biomedical data?
2. How do we ingest and contextualise sequencing data?
3. How do we discover new relationships?
Follow us @GraknLabs
Grakn accelerates biomedical knowledge discovery
Faster ingestion and integration
of data
Contextualise newly generated
insights
Discover and explain new
relationships
Grakn’s hyper-relational data model
enables fast and flexible integration of
heterogeneous biomedical data sets
Bring context to newly generated
insights by understanding how it
interacts with the rest of the graph
Through automated deductive
reasoning of data points derive new
relationships between biological
components
T H E K N O W L E D G E G R A P H
Join our community at grakn.ai/community
Using Grakn in Protein
Sequence Alignment
By Tomas Sabat
COO of GRAKN.AI
@graknlabs
@tasabat

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Using Grakn to Analyse Protein Sequence Alignment

  • 1. T H E K N O W L E D G E G R A P H Join our community at grakn.ai/community Using Grakn in Protein Sequence Alignment By Tomas Sabat COO of GRAKN.AI @graknlabs @tasabat
  • 2. Follow us @GraknLabs We push the boundary of intelligent systems forward, starting at the database.
  • 3. Follow us @GraknLabs Integrating datasets Contextualisation of insights Discovery of new relationships Difficult to integrate heterogeneous and flat datasets Difficult to ingest insights and connect with rest of public/private data Difficult to reason and discover new explainable relationships What problems have we found in bioinformatics?
  • 4. Follow us @GraknLabs Grakn accelerates biomedical knowledge discovery Faster ingestion and integration of data Contextualise newly generated insights Discover and explain new relationships Grakn’s hyper-relational data model enables fast and flexible integration of heterogeneous biomedical data sets Bring context to newly generated insights by understanding how it interacts with the rest of the graph Through automated deductive reasoning of data points derive new relationships between biological components
  • 5. Follow us @GraknLabs GRAKN.AI the knowledge base foundation for intelligent systems a.k.a., GRAKN.AI is a knowledge graph Knowledge Storage System Novel Knowledge Representation System based on Hypergraph Theory Knowledge Inference OLTP Reasoning Engine Knowledge Analytics OLAP Distributed Analytics
  • 6. Follow us @GraknLabs 1. How do we integrate biomedical data?
  • 8. Follow us @GraknLabs Integrating data Protein Kinase sub Ion -channel Nuclear- receptor GPCR sub sub sub
  • 9. Follow us @GraknLabs Integrating data Drug Disease Protein Gene Kinase sub Ion -channel Nuclear- receptor GPCR sub sub sub
  • 10. Follow us @GraknLabs Integrating data Drug Disease Protein Gene gene- protein- encoding encoding-gene encoded-protein Kinase sub Ion -channel Nuclear- receptor GPCR sub sub sub
  • 11. Follow us @GraknLabs Integrating data Protein Drug DiseaseGene encoding-gene encoded-protein protein- disease- associati on associated-protein associated-disease associated-diseaseassociated-gene drug- protein- interaction target-protein interacted-drug drug-gene- interaction inhibitor target-gene drug-- disease- association affected-disease therapeutic gene- protein- encoding gene- disease- association Kinase sub Ion -channel Nuclear- receptor GPCR sub sub sub
  • 12. Follow us @GraknLabs Hyper-Relationship Example: Nested-Relationship Protein Protein Tissue PPI loc interacting interacting data source has
  • 13. Follow us @GraknLabs Hyper-Relationship Example: Ternary-Relationship Drug Disease Side effect therapeutic effect ass
  • 14. Follow us @GraknLabs 2. How do we ingest and contextualise sequencing data?
  • 15. Follow us @GraknLabs How do we ingest and contextualise sequencing data? Protein Drug Disease Gene encoding-gene encoded-protein protein- disease- associati on associated- protein associated-disease associated-disease associated-gene drug- protein- interaction target-protein interacted-drug drug-gene- interaction inhibitor target-gene drug- disease- association affected-disease therapeutic gene- protein- encoding gene- disease- association Kinase sub Ion -channel Nuclear- receptor GPCR sub sub sub
  • 16. Follow us @GraknLabs How do we ingest and contextualise sequencing data? Protein Drug Disease Gene protein- protein- alignment target-protein matched-protein encoding-gene encoded-protein protein- disease- associati on associated- protein associated-disease associated-disease associated-gene drug- protein- interaction target-protein interacted-drug drug-gene- interaction inhibitor target-gene drug- disease- association affected-disease therapeutic gene- protein- encoding gene- disease- association sequence Kinase sub Ion -channel Nuclear- receptor GPCR sub sub sub
  • 17. Follow us @GraknLabs How do we ingest and contextualise sequencing data? Protein Drug Disease Gene protein- protein- alignment target-protein matched-protein encoding-gene encoded-protein protein- disease- associati on associated- protein associated-disease associated-disease associated-gene drug- protein- interaction target-protein interacted-drug drug-gene- interaction inhibitor target-gene drug- disease- association affected-disease therapeutic gene- protein- encoding gene- disease- association sequenceSequence- sequence- alignment target-seq matched-seq Kinase sub Ion -channel Nuclear- receptor GPCR sub sub sub
  • 18. Follow us @GraknLabs How do we ingest and contextualise sequencing data? Protein Drug Disease Gene protein- protein- alignment target-protein matched-protein encoding-gene encoded-protein protein- disease- associati on associated- protein associated-disease associated-disease associated-gene drug- protein- interaction target-protein interacted-drug drug-gene- interaction inhibitor target-gene drug- disease- association affected-disease therapeutic gene- protein- encoding gene- disease- association sequenceSequence- sequence- alignment target-seq matched-seq sequence- positivity sequence- identicality Kinase sub Ion -channel Nuclear- receptor GPCR sub sub sub
  • 19. Follow us @GraknLabs 3. How do we discover and explain new relationships?
  • 20. Follow us @GraknLabs How do we discover new relationships? Protein Drug Disease Gene protein- protein- alignment target-protein matched-protein encoding-gene encoded-protein protein- disease- associati on associated- protein associated-disease associated-disease associated-gene drug- protein- interaction target-protein interacted-drug drug-gene- interaction inhibitor target-gene drug- disease- association affected-disease therapeutic gene- protein- encoding gene- disease- association sequenceSequence- sequence- alignment target-seq matched-seq sequence- positivity sequence- identicality Kinase sub Ion -channel Nuclear- receptor GPCR sub sub sub
  • 21. Follow us @GraknLabs Complex Query Example Asthma Disease Gene Nuclear Receptor Kinase Ion channel GPCR Nuclear Receptor Kinase Ion channel GPCR Gene Drug seq seq seq seq seq seq seq seq ass ass ass ass ass ass ass ass enc enc enc enc What drugs are associated to “Asthma”? align id pos
  • 22. Follow us @GraknLabs align Complex Query Example Asthma Disease Gene Nuclear Receptor Kinase Ion channel GPCR Nuclear Receptor Kinase Ion channel GPCR Gene Drug seq seq align seq seq seq seq seq seq ass ass ass ass ass ass ass ass enc enc enc enc What drugs are associated to “Asthma”? id pos
  • 23. Follow us @GraknLabs Rule Example: Transitive Relationship Protein Protein align Drug ass ass Disease ass
  • 24. Follow us @GraknLabs Rule Example: Transitive Relationship Protein Protein align Drug ass ass Disease ass
  • 25. Follow us @GraknLabs Rule Example: Chained Rules Protein sequence- alignment Protein sequence sequence protein- alignment seq-pos seq-id >0.9 >0.9
  • 26. Follow us @GraknLabs Rule Example: Chained Rules Protein sequence- alignment Protein sequence sequence protein- alignment seq-pos seq-id >0.9 >0.9
  • 27. Follow us @GraknLabs 1. How do we integrate so much biomedical data? 2. How do we ingest and contextualise sequencing data? 3. How do we discover new relationships?
  • 28. Follow us @GraknLabs Grakn accelerates biomedical knowledge discovery Faster ingestion and integration of data Contextualise newly generated insights Discover and explain new relationships Grakn’s hyper-relational data model enables fast and flexible integration of heterogeneous biomedical data sets Bring context to newly generated insights by understanding how it interacts with the rest of the graph Through automated deductive reasoning of data points derive new relationships between biological components
  • 29. T H E K N O W L E D G E G R A P H Join our community at grakn.ai/community Using Grakn in Protein Sequence Alignment By Tomas Sabat COO of GRAKN.AI @graknlabs @tasabat