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Volumn 19, Issue 6, 2009, Pages 1650-1653

Inhibitory activity of prostaglandin E2 production by the synthetic 2′-hydroxychalcone analogues: Synthesis and SAR study

Author keywords

Anti inflammation; Chalcone; COX 2; Cytotoxicity; PGE2

Indexed keywords

2' HYDROXY 3,4,5 TRIMETHOXYCHALCONE; 2' HYDROXYCHALCONE DERIVATIVE; 2,3 DIMETHOXY 2' HYDROXYCHALCONE; 2,4 DIMETHOXY 2' HYDROXYCHALCONE; 3 BENZYLOXY 4 METHOXY 2' HYDROXYCHALCONE; 3,4 DIBENZYLOXY 2' HYDROXYCHALCONE; 3,4,5 TRIMETHOXY 2' HYDROXYCHALCONE; 4 BENZYLOXY 2' HYDROXYCHALCONE; CHALCONE DERIVATIVE; CYCLOOXYGENASE 2; PROSTAGLANDIN E2; UNCLASSIFIED DRUG;

EID: 61649095702     PISSN: 0960894X     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.bmcl.2009.02.001     Document Type: Article
Times cited : (42)

References (31)
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    • 2) to give the product.
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    • 3) C, H, O.
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    • note
    • 2 according to the manufacturer's recommendation. All experiments were carried out at least three times.
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    • Chemical Computing Group Inc
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    • note
    • -1. The lowest-energy conformer of each molecule was selected and stored in mdb database. Preparation of target enzyme structure and docking. The X-ray crystal structure of COX-2:SC-558 complex (pdb 1cx2) was retrieved from the RCSB Protein Data Bank (www.rcsb.org). The active site was defined as all the amino acid residues enclosed within 6.5 Å radius sphere centered by the bound ligand, SC-558 (1-phenylsulfonamied-3-trifluoromethyl-5-parabromophenyl-pyrazole, a selective COX-2 inhibitor) and 'site finder' in MOE was used to determine the binding site. The docking and subsequent scoring were performed using the MOE docking programs. The final of 30 docked conformations per ligand were analyzed and used to create the illustrative figures.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.