INVESTIGATION ON QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIPS OF BENZOYLAMINO BENZOIC ACID DERIVATIVES AS Β-KETOACYL-ACYL CARRIER PROTEIN SYNTHASE III (FABH) INHIBITORS

PP SUBRAMANİ, SV KHARE, SP CHOUDHARİ, SP PHALLE, SS KUMBHAR, VS KAVADE, AA PRATAVALE, PB CHOUDHARİ

Journal of Research in Pharmacy - 2017;21(3):631-643

Department of Pharmaceutical Chemistry, Bharati Vidyapeeth College of Pharmacy, Kolhapur, Maharashtra

 

Fatty acid biosynthesis is an important process in the microorganism life cycle. β-Ketoacyl-acyl Carrier Protein Synthase III (FABH) catalyzes a critical step in fatty acid biosynthesis via type ii fatty acid biosynthesis. Series of 43 Benzoyl amino benzoic acid derivatives were subjected to 2D and 3D quantitative structure-activity relationships (QSAR) analysis via multiple linear regression and partial least square analysis respectively. Statistically significant four QSAR models were developed with good cross-validated correlation coefficient and external validation values. Developed QSAR model indicated the significance of the lipophilic parameters in an inhibitory potential of benzoyl amino benzoic acid derivatives.