ChEMBL’ - Warwick

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ChEMBL What does it contain? Protein, Blast & Compound Searching Malaria Data Neglected Tropical Disease (NTD) archive Target & Taxonomy Browsing Drug Approvals

Transcript of ChEMBL’ - Warwick

Page 1: ChEMBL’ - Warwick

ChEMBL  What  does  it  contain?

 

 

Protein,  Blast  &  Compound  Searching  

Malaria  Data   Neglected  Tropical  Disease  (NTD)  archive

Target  &  Taxonomy  Browsing

     Drug  Approvals

WMG - Warwick

WMG - Warwick

Warwick Ward

Warwick Ward

University of Warwick - Essential Warwick 2011

University of Warwick - Essential Warwick 2011

TEDx Warwick

TEDx Warwick

Warwick - AlienBass

Warwick - AlienBass

Hf Warwick

Hf Warwick

Warwick - Framus

Warwick - Framus

ChEMBL – Open Access Database For Drug Discovery

ChEMBL – Open Access Database For Drug Discovery

ChEMBL & RDKit · 2012. 10. 15. · Fragment library • From a set of ChEMBL molecules, RECAP* algorithm was applied. • A filter based on the number of heavy atoms and molecular

ChEMBL & RDKit · 2012. 10. 15. · Fragment library • From a set of ChEMBL molecules, RECAP* algorithm was applied. • A filter based on the number of heavy atoms and molecular

ChEMBL database to model target of chemical compounds

ChEMBL database to model target of chemical compounds

Anne Hersey ChEMBL Group, EMBL-EBI ChEMBL – A Database of Bioactive Drug-like Small Molecules.

Anne Hersey ChEMBL Group, EMBL-EBI ChEMBL – A Database of Bioactive Drug-like Small Molecules.

ChEMBL – Large-Scale Open Access Data for Drug Discovery John Overington EMBL-EBI jpo@ebi.ac.uk.

ChEMBL – Large-Scale Open Access Data for Drug Discovery John Overington EMBL-EBI [email protected].

1728 WARWICK AVENUE WARWICK - RHODE ISLAND...1728 WARWICK AVENUE WARWICK - RHODE ISLAND • 6,500 SF Building • 15,246 SF of land • Signalized intersection • Office, service

1728 WARWICK AVENUE WARWICK - RHODE ISLAND...1728 WARWICK AVENUE WARWICK - RHODE ISLAND • 6,500 SF Building • 15,246 SF of land • Signalized intersection • Office, service

ChEMBL & RDKitrdkit.org/UGM/2012/Ochoa.RDKit-presentation_Final.pptx.pdfSAR Data Compound y Ki = 4.5 nM >Thrombin MAHVRGLQLPGCLALAALCSLVHSQHVFLAPQQARSLLQRVRRANTFLEEVRKGNLERECVEETCS

ChEMBL & RDKitrdkit.org/UGM/2012/Ochoa.RDKit-presentation_Final.pptx.pdfSAR Data Compound y Ki = 4.5 nM >Thrombin MAHVRGLQLPGCLALAALCSLVHSQHVFLAPQQARSLLQRVRRANTFLEEVRKGNLERECVEETCS

Warwick evidence

Warwick evidence

Heat Treating Data Book - SECO/WARWICK GROUP » SECO/WARWICK

Heat Treating Data Book - SECO/WARWICK GROUP » SECO/WARWICK

MATHEMATICS - Warwick

MATHEMATICS - Warwick

ControlCenter2 - Warwick

ControlCenter2 - Warwick

Warwick Catalog

Warwick Catalog

PubChem and ChEMBL Beyond Lipinski

PubChem and ChEMBL Beyond Lipinski