A Computational Approach towards the Development of Newer Anticancer Agents
In silico molecular docking analyses of the novel 1-(2', 4'-dihydroxy-5'-chlorophenyl)-3-aryl-propane-1, 3-diones were performed in the active sites of enzyme cytochrome P450 reductase to obtain new anticancer agents computationally. 1-(2', 4'-dihydroxy-5'-chlorophenyl)...
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| Main Authors: | , , |
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| Format: | Article |
| Language: | English |
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Wiley
2010-01-01
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| Series: | E-Journal of Chemistry |
| Online Access: | http://dx.doi.org/10.1155/2010/582710 |
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| _version_ | 1832552048312188928 |
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| author | Javed I. Sheikh H. D. Juneja V. N. Ingle |
| author_facet | Javed I. Sheikh H. D. Juneja V. N. Ingle |
| author_sort | Javed I. Sheikh |
| collection | DOAJ |
| description | In silico molecular docking analyses of the novel 1-(2', 4'-dihydroxy-5'-chlorophenyl)-3-aryl-propane-1, 3-diones were performed in the active sites of enzyme cytochrome P450 reductase to obtain new anticancer agents computationally. 1-(2', 4'-dihydroxy-5'-chlorophenyl)-3-(4"-methoxy-phenyl)-propane-1, 3-dione (3f) was found to have maximum affinity for the active sites of enzyme. |
| format | Article |
| id | doaj-art-cf04eab74c2641cab083b6f1d9f06f7b |
| institution | Kabale University |
| issn | 0973-4945 2090-9810 |
| language | English |
| publishDate | 2010-01-01 |
| publisher | Wiley |
| record_format | Article |
| series | E-Journal of Chemistry |
| spelling | doaj-art-cf04eab74c2641cab083b6f1d9f06f7b2025-02-03T05:59:45ZengWileyE-Journal of Chemistry0973-49452090-98102010-01-0171212410.1155/2010/582710A Computational Approach towards the Development of Newer Anticancer AgentsJaved I. Sheikh0H. D. Juneja1V. N. Ingle2Organic Chemistry Research Laboratory, Department of Chemistry, RTM Nagpur University, Nagpur-440 033, IndiaOrganic Chemistry Research Laboratory, Department of Chemistry, RTM Nagpur University, Nagpur-440 033, IndiaOrganic Chemistry Research Laboratory, Department of Chemistry, RTM Nagpur University, Nagpur-440 033, IndiaIn silico molecular docking analyses of the novel 1-(2', 4'-dihydroxy-5'-chlorophenyl)-3-aryl-propane-1, 3-diones were performed in the active sites of enzyme cytochrome P450 reductase to obtain new anticancer agents computationally. 1-(2', 4'-dihydroxy-5'-chlorophenyl)-3-(4"-methoxy-phenyl)-propane-1, 3-dione (3f) was found to have maximum affinity for the active sites of enzyme.http://dx.doi.org/10.1155/2010/582710 |
| spellingShingle | Javed I. Sheikh H. D. Juneja V. N. Ingle A Computational Approach towards the Development of Newer Anticancer Agents E-Journal of Chemistry |
| title | A Computational Approach towards the Development of Newer Anticancer Agents |
| title_full | A Computational Approach towards the Development of Newer Anticancer Agents |
| title_fullStr | A Computational Approach towards the Development of Newer Anticancer Agents |
| title_full_unstemmed | A Computational Approach towards the Development of Newer Anticancer Agents |
| title_short | A Computational Approach towards the Development of Newer Anticancer Agents |
| title_sort | computational approach towards the development of newer anticancer agents |
| url | http://dx.doi.org/10.1155/2010/582710 |
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