Discovery of a new type inhibitor of human glyoxalase i by myricetin-based 4-point pharmacophore

Bioorganic and Medicinal Chemistry Letters

Volumn 21, Issue 14, 2011, Pages 4337-4342

  Takasawa, Ryoko ^a   Tao, Akinobu ^a   Saeki, Kazunori ^a   Shionozaki, Nobuhiro ^a   Tanaka, Ryo ^a   Uchiro, Hiromi ^a   Takahashi, Satoshi ^b   Yoshimori, Atsushi ^b   Tanuma, Sei Ichi ^a  

^a TOKYO UNIVERSITY OF SCIENCE   (Japan)

^b Institute for Theoretical Medicine Inc   (Japan)

Author keywords

Glyoxalase I; In silico screening; Inhibitor; Pharmacophore modeling; Structure activity relationship

Indexed keywords

BENZOTHIAZOLE; BROMOBENZYLGLUTATHIONE; CARBOXYL GROUP; GLUTATHIONE DERIVATIVE; LACTOYLGLUTATHIONE LYASE; LYASE INHIBITOR; MYRICETIN; TLSC 701; TLSC 702; TLSC 703; TLSC 704; TLSC 705; TLSC 706; TLSC 707; TLSC 708; TLSC 709; UNCLASSIFIED DRUG; ZINC OXIDE;

ANTINEOPLASTIC ACTIVITY; ARTICLE; COMPUTER MODEL; DRUG BINDING; DRUG INHIBITION; DRUG SCREENING; HUMAN; HYDROGEN BOND; MOLECULAR DOCKING; PHARMACOPHORE; SIMULATION;

BINDING SITES; CATALYTIC DOMAIN; COMPUTER SIMULATION; DRUG EVALUATION, PRECLINICAL; ENZYME INHIBITORS; FLAVONOIDS; HUMANS; LACTOYLGLUTATHIONE LYASE; RECOMBINANT PROTEINS; STRUCTURE-ACTIVITY RELATIONSHIP;

EID: 79959864284     PISSN: 0960894X     EISSN: 14643405     Source Type: Journal    
DOI: 10.1016/j.bmcl.2011.05.046     Document Type: Article

References (18)

1. P.J. Thornalley, L.G. Edwards, Y. Kang, C. Wyatt, N. Davies, M.J. Ladan, and J. Double Biochem. Pharmacol. 51 1996 1365
2. S.D. Davidson, J.P. Cherry, M.S. Choudhury, H. Tazaki, C. Mallouh, and S. Konno J. Urol. 161 1999 690
3. S. Ranganathan, and K.D. Tew Biochim. Biophys. Acta 1182 1993 311
4. H. Sakamoto, T. Mashima, S. Sato, Y. Hashimoto, T. Yamori, and T. Tsuruo Clin. Cancer Res. 7 2001 2513
5. H. Sakamoto, T. Mashima, A. Kizaki, S. Dan, Y. Hashimoto, M. Naito, and T. Tsuruo Blood 95 2000 3214
6. R. Vince, and S. Daluge J. Med. Chem. 14 1971 35
7. S.S. More, and R. Vince J. Med. Chem. 52 2009 4650
8. A. Al-Timari, and K.T. Douglas Biochim. Biophys. Acta 870 1986 160
9. T.W. Lo, and P.J. Thornalley Biochem. Pharmacol. 44 1992 2357
10. D.S. Hamilton, and D.J. Creighton J. Biol. Chem. 267 1992 24933
11. N.S. Murthy, T. Bakeris, M.J. Kavarana, D.S. Hamilton, Y. Lan, and D.J. Creighton J. Med. Chem. 37 1994 2161
12. R. Takasawa, S. Takahashi, K. Saeki, S. Sunaga, A. Yoshimori, and S. Tanuma Bioorg. Med. Chem. 16 2008 3969
13. A.D. Cameron, B. Olin, M. Ridderström, B. Mannervik, and T.A. Jones EMBO J. 16 1997 3386
14. R. Takasawa, K. Saeki, A. Tao, A. Yoshimori, H. Uchiro, M. Fujiwara, and S. Tanuma Bioorg. Med. Chem. 18 2010 7029
15. M. Shinohara, P.J. Thornalley, I. Giardino, P. Beisswenger, S.R. Thorpe, J. Onorato, and M. Brownlee J. Clin. Invest. 101 1998 1142
16. M.R. Lee, Y. Duan, and P.A. Kollman Proteins: Struct. Funct. Genet. 39 2000 309
17. J. Wang, P. Morin, W. Wang, and P.A. Kollman J. Am. Chem. Soc. 123 2001 5221
18. J.M.J. Swanson, R.H. Henchman, and J.A. McCammon Biophys. J. 86 2004 67