%0 Generic %A Southan, Christopher %D 2014 %T AZ_MRC compounds with PubChem IDs and patent mappings %U https://figshare.com/articles/dataset/AZ_MRC_compounds_with_PubChem_IDs_and_patent_mappings/95806 %R 10.6084/m9.figshare.95806.v3 %2 https://ndownloader.figshare.com/files/1373123 %K drugs %K Bioinformatics %X

See updates below introduction

I have performed the same exercise as described for the NCATS 56 small molecules, Namely to 1) map the code name to a structure,  2) assign these to a PubChem CID and 3) search SureChemOpen for matches to early patent filings (details are given in blog link below)



Updates:  October:  InChIKey  for AZD1656 has been added to this descrition page  as a Google indexing an retrieval test   FJEJHJINOKKDCW-INIZCTEOSA-N

Sept 2012) InChIKey added as a new column in the Excell file for Google indexing and are now retrievable by searching the key in Google


Update Jan 2014:  Now at 58 structures from 78 codes

 


 

 

 

 

 




%I figshare