Paper: Fuelling Open-Source Drug Discovery: 177 Small-Molecule Leads against Tuberculosis

As it was announced last year, some of our collaborators in GSK Tres Cantos just published the results of a large antimycobacterial phenotypic screening campaign against Mycobacterium bovis BCG with hit confirmation in M. tuberculosis H37Rv. After the screening and in silico cascade, a set of 177 potent non-cytotoxic H37Rv hits was identified, providing a plethora of diverse potential starting points for new synthetic lead-generation activities to the global scientific community.

The dataset is hosted in ChEMBL and can be downloaded from here with a short description here.

%T Fueling Open-Source Drug Discovery: 177 Small-Molecule Leads against Tuberculosis

%A L. Ballell

%A R.H. Bates

%A R.J. Young

%A D. Alvarez-Gomez

%A E. Alvarez-Ruiz

%A V. Barroso

%A D. Blanco

%A B. Crespo

%A J. Escribano

%A R. González

%A S. Lozano

%A S. Huss

%A A. Santos-Villarejo

%A J.J. Martín-Plaza

%A A. Mendoza

%A M.J. Rebollo-Lopez

%A M. Remuiñan-Blanco

%A J.L. Lavandera

%A E. Pérez-Herran

%A F.J. Gamo-Benito

%A J.F. García-Bustos

%A D. Barros

%A J.P. Castro

%A N. Cammack

%J ChemMedChem

%O http://dx.doi.org/10.1002/cmdc.201200428

George

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