|
|||||
|
|
Diversely substituted sulfamides for fragment-based drug discovery of carbonic anhydrase inhibitors: synthesis and inhibitory profile |
|
| Authors: | Tatiana Sharonova Petr Zhmurov Stanislav Kalinin Alessio Nocentini Andrea Angeli Marta Ferraroni Mikhail Korsakov Claudiu T. Supuran Mikhail Krasavin |
| Affiliation: | aInstitute of Chemistry, Saint Petersburg State University, Saint Petersburg, Russia;bNeurofarba Department, Universita Degli Studi di Firenze, Florence, Italy;cPharmaceutical Technology Transfer Center, Ushinsky Yaroslavl State Pedagogical University, Yaroslavl, Russia |
| Abstract: | A series of sulfamide fragments has been synthesised and investigated for human carbonic anhydrase inhibition. One of the fragments showing greater selectivity for cancer-related isoforms hCA IX and XII was co-crystalized with hCA II showing significant potential for fragment periphery evolution via fragment growth and linking. These opportunities will be identified in the future via the screening of this fragment structure for co-operative carbonic anhydrase binding with other structurally diverse fragments.Open in a separate window |
| Keywords: | Carbonic anhydrase zinc-binding groups sulfamides co-operative fragment screening solubility |