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dc.contributor.authorAl-Najjar, Belal O-
dc.contributor.authorShakya, Ashok K-
dc.contributor.authorSaqallah, Fadi G-
dc.contributor.authorSaid, Rana-
dc.identifier.issn0975-0983(Online); 0376-4699(Print)-
dc.description.abstract15-Hydroxyprostaglandin dehydrogenase (15-PGDH) plays an important role in gastric ulcer healing, bone formation and dermal wound healing, encouraging several efforts to discover and optimize new inhibitors. We explored possible pharmacophoric space of 15-PGDH using four diverse sets of inhibitors. After that, GA and MLR methods have been employed to identify the optimal pharmacophore model(s) and physicochemical descriptors able to access Quantitative structure-activity relationship equation (r2=0.711, r2(adj)=0.6927, r2(LOO)= 0.6598). One pharmcophore model has emerged in the Quantitative structure-activity relationship equation and has been validated by ROC curve analysis and molecular docking.en_US
dc.publisherNISCAIR-CSIR, Indiaen_US
dc.rights CC Attribution-Noncommercial-No Derivative Works 2.5 Indiaen_US
dc.sourceIJC-B Vol.56B(11) [November 2017]en_US
dc.subjectPharmacophore modelingen_US
dc.subjectQuantitative structure-activity relationshipen_US
dc.titlePharmacophore modeling and 3D-QSAR studies of 15-hydroxyprostaglandin dehydrogenase (15-PGDH) inhibitorsen_US
Appears in Collections:IJC-B Vol.56B(11) [November 2017]

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