Detail Information of Xenobiotics

General Information of Xenobiotics (ID: XEO00013)
Xenobiotics Name
Celecoxib
Xenobiotics Type
Pharmaceutical Agent(s)
Classification
Approved/Marketed Drug
Structure
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3D MOL 2D MOL
PubChem CID
2662
DME(s) Modulated by This Xenobiotics
DME(s) Inhibited by This Xenobiotics
Carbonic anhydrase II (CA2) DME Info Homo sapiens [1]
Catalase (CAT) DME Info Homo sapiens [2]
Aromatase (CYP19A1) DME Info Homo sapiens [3]
Cytochrome P450 1A2 (CYP1A2) DME Info Homo sapiens [4]
Mevalonate pyrophosphate decarboxylase (MPD) DME Info Homo sapiens [5]
Prostaglandin G/H synthase 1 (COX-1) DME Info Homo sapiens [6]
Prostaglandin G/H synthase 2 (COX-2) DME Info Homo sapiens [7], [8]
DME(s) Induced by This Xenobiotics
Glutathione S-transferase pi (GSTP1) DME Info Homo sapiens [9]
Xenobiotics-DME Activity Data
Xenobiotics-DME Activity Data Carbonic anhydrase II (CA2) DME Info IC50 = 0.021 microM [1]
Prostaglandin G/H synthase 1 (COX-1) DME Info IC50 < 100 microM [6]
Prostaglandin G/H synthase 2 (COX-2) DME Info IC50 < 0.3 microM [7], [8]
References
1 Designed multiple ligandsAn emerging drug discovery paradigm. J Med Chem. 2005 Oct 20;48(21):6523-43.
2 Selective COX-2 inhibitors modulate cellular senescence in human dermal fibroblasts in a catalytic activity-independent manner. Mech Ageing Dev. 2008 Dec;129(12):706-13.
3 Translational studies on aromatase, cyclooxygenases, and enzyme inhibitors in breast cancer. J Steroid Biochem Mol Biol. 2005 May;95(1-5):129-36.
4 In vitro inhibition of CYP1A2 by model inhibitors, anti-inflammatory analgesics and female sex steroids: predictability of in vivo interactions. Basic Clin Pharmacol Toxicol. 2008 Aug;103(2):157-65.
5 Effect of celecoxib on E-cadherin, VEGF, Microvessel density and apoptosis in gastric cancer. Cancer Biol Ther. 2007 Feb;6(2):269-75.
6 Synthesis and structure-activity relationship of novel, highly potent metharyl and methcycloalkyl cyclooxygenase-2 (COX-2) selective inhibitors. J Med Chem. 2003 Dec 4;46(25):5484-504.
7 Synthesis and biological evaluation of some thiazolyl and thiadiazolyl derivatives of 1H-pyrazole as anti-inflammatory antimicrobial agents. Eur J Med Chem. 2008 Mar;43(3):456-63.
8 Synthesis and biological evaluation of some thiazolylpyrazole derivatives as dual anti-inflammatory antimicrobial agents. Eur J Med Chem. 2010 Dec;45(12):6027-38.
9 The effects of cyclooxygenase-2 expression in prostate cancer cells: modulation of response to cytotoxic agents. J Pharmacol Exp Ther. 2008 Mar;324(3):1181-7.

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