Title : Synthesis, anti-inflammatory, analgesic, COX1/2-inhibitory activity, and molecular docking studies of hybrid pyrazole analogues.

Pub. Date : 2016

PMID : 27826185






4 Functional Relationships(s)
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Protein Name
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1 These selective COX2 inhibitors were docked into the active site of COX2, and showed the same orientation and binding mode to that of celecoxib (selective COX2 inhibitor). Celecoxib mitochondrially encoded cytochrome c oxidase II Homo sapiens
2 These selective COX2 inhibitors were docked into the active site of COX2, and showed the same orientation and binding mode to that of celecoxib (selective COX2 inhibitor). Celecoxib mitochondrially encoded cytochrome c oxidase II Homo sapiens
3 These selective COX2 inhibitors were docked into the active site of COX2, and showed the same orientation and binding mode to that of celecoxib (selective COX2 inhibitor). Celecoxib mitochondrially encoded cytochrome c oxidase II Homo sapiens
4 Docking studies also showed that the SO2NH2 of 5u and 5s is inserted deep inside the selective pocket of the COX2-active site and formed a hydrogen-bond interaction with His90, Arg513, Phe518, Ser353, Gln192, and Ile517, which was further validated by superimposed docked pose with celecoxib. Celecoxib mitochondrially encoded cytochrome c oxidase II Homo sapiens