Ontology highlight
ABSTRACT:
SUBMITTER: Kalva S
PROVIDER: S-EPMC3338973 | biostudies-literature | 2012
REPOSITORIES: biostudies-literature
Kalva Sukesh S Vadivelan S S Sanam Ramadevi R Jagarlapudi Sarma Arp SA Saleena Lilly M LM
Bioinformation 20120413 7
In this study, chemical feature based pharmacophore models of MMP-1, MMP-8 and MMP-13 inhibitors have been developed with the aid of HypoGen module within Catalyst program package. In MMP-1 and MMP-13, all the compounds in the training set mapped HBA and RA, while in MMP-8, the training set mapped HBA and HY. These features revealed responsibility for the high molecular bioactivity, and this is further used as a three dimensional query to screen the knowledge based designed molecules. These phar ...[more]