pp Subramani, Shivratna V. Khare, Sujata P. Choudhari, S. Phalle, Santosh S. Kumbhar, Vs Kavade, Aa Pratavale, P. Choudhari
{"title":"苯甲酰氨基苯甲酸acıd衍生物作为β-酮酰基酰基carrıer蛋白合成酶ııı (fabh)抑制剂的quantitatıve结构活性relationshıps研究","authors":"pp Subramani, Shivratna V. Khare, Sujata P. Choudhari, S. Phalle, Santosh S. Kumbhar, Vs Kavade, Aa Pratavale, P. Choudhari","doi":"10.12991/MARUPJ.323295","DOIUrl":null,"url":null,"abstract":"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.","PeriodicalId":18529,"journal":{"name":"Marmara Pharmaceutical Journal","volume":"38 1","pages":"631-643"},"PeriodicalIF":0.0000,"publicationDate":"2017-06-23","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"1","resultStr":"{\"title\":\"Investigation on quantitatıve structure-activity relationshıps of benzoylamino benzoic acıd derivatives as β-ketoacyl-acyl carrıer protein synthase ııı (fabh) inhibitors\",\"authors\":\"pp Subramani, Shivratna V. Khare, Sujata P. Choudhari, S. Phalle, Santosh S. Kumbhar, Vs Kavade, Aa Pratavale, P. Choudhari\",\"doi\":\"10.12991/MARUPJ.323295\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"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.\",\"PeriodicalId\":18529,\"journal\":{\"name\":\"Marmara Pharmaceutical Journal\",\"volume\":\"38 1\",\"pages\":\"631-643\"},\"PeriodicalIF\":0.0000,\"publicationDate\":\"2017-06-23\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"1\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Marmara Pharmaceutical Journal\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://doi.org/10.12991/MARUPJ.323295\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"\",\"JCRName\":\"\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Marmara Pharmaceutical Journal","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.12991/MARUPJ.323295","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
Investigation on quantitatıve structure-activity relationshıps of benzoylamino benzoic acıd derivatives as β-ketoacyl-acyl carrıer protein synthase ııı (fabh) inhibitors
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.