3D-QSAR study of sulfonamide inhibitors of human carbonic anhydrase II

European Journal of Medicinal Chemistry

Volumn 42, Issue 3, 2007, Pages 365-372

  Huang, Huoqiang ^a,b   Pan, Xulin ^a,b   Tan, Ninghua ^a   Zeng, Guangzhi ^a,b   Ji, Changjiu ^a,b  

^a KUNMING INSTITUTE OF BOTANY   (China)

^b UNIVERSITY OF CHINESE ACADEMY OF SCIENCES   (China)

Author keywords

3D QSAR; Carbonic anhydrase II; Sulfonamide

Indexed keywords

1,3,4 THIADIAZOLE DERIVATIVE; BENZENE SULFONAMIDE DERIVATIVE; CARBONATE DEHYDRATASE II; CARBONATE DEHYDRATASE INHIBITOR; HETEROCYCLIC COMPOUND; HYDROGEN; SULFONAMIDE; TRIAZOLE DERIVATIVE; UNCLASSIFIED DRUG;

ARTICLE; CONFORMATION; CONTROLLED STUDY; DRUG POTENCY; ENZYME INHIBITION; HUMAN; IN VITRO STUDY; PREDICTION; QUANTITATIVE STRUCTURE ACTIVITY RELATION;

CARBONIC ANHYDRASE II; CARBONIC ANHYDRASE INHIBITORS; HUMANS; HYDROGEN BONDING; LEAST-SQUARES ANALYSIS; MODELS, MOLECULAR; QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIP; REPRODUCIBILITY OF RESULTS; SUBSTRATE SPECIFICITY; SULFONAMIDES;

EID: 33847378018     PISSN: 02235234     EISSN: 17683254     Source Type: Journal    
DOI: 10.1016/j.ejmech.2006.09.022     Document Type: Article

References (15)

1. Zeng G.Z., Huang H.Q., Tan N.H., Ji C.J., and Pan X.L. Acta Bot. Yunnan. 28 (2006) 543-552
2. Tan N.H., Fu X., Ji C.J., Zeng G.Z., Jiang L.H., and Jia R.R. Chin. J. Org. Chem. 24 Suppl. 139 (2004)
3. Jackman J.E., Merz Jr. K.M., and Fierke C.A. Biochemistry 35 (1996) 16421-16428
4. Vicker N., Ho Y., Robinson J., Woo L.L.W., Purohit A., Reed M.J., and Potter B.V.L. Bioorg. Med. Chem. Lett. 13 (2003) 863-865
5. Supuran C.T., Scozzafava A., and Casini A. Med. Res. Rev. 23 (2003) 146-189
6. Maren T.H., and Conroy C.W. J. Biol. Chem. 268 (1993) 26233-26239
7. Fu X., Tan N.H., Jiang L.H., Jia R.R., Ji C.J., Landro J., Fekete A., Mueller H., and Henkel T. Acta Bot. Yunnan 25 (2003) 724-729
8. Garaj V., Puccetti L., Fasolis G., Winum J.-Y., Montero J.-L., Scozzafava A., Vullo D., Innocenti A., and Supuran C.T. Bioorg. Med. Chem. Lett. 15 (2005) 3102-3108
9. Turkmen H., Durgun M., Yilmaztekin S., Emul M., Innocenti A., Vullo D., Scozzafava A., and Supuran C.T. Bioorg. Med. Chem. Lett. 15 (2005) 367-372
10. Garaj V., Puccetti L., Fasolis G., Winum J.-Y., Montero J.-L., Scozzafava A., Vullo D., Innocenti A., and Supuran C.T. Bioorg. Med. Chem. Lett. 14 (2004) 5427-5433
11. Sybyl Version 6.9 (2001), Tripos Associates, St. Louis (MO)
12. Clark M., Cramer R.D., and Opdenbosch N.V. J. Comput. Chem. 10 (1989) 982-1012
13. Parra-Delgado H., Compadre C.M., Ramírez-Apan T., Muñoz-Fambuena M.J., Compadre R.L., Ostrosky-Wegman P., and Martínez-Vázquez M. Bioorg. Med. Chem. 14 (2006) 1889-1901
14. Pan X.L., Tan N.H., Zeng G.Z., Zhang Y.M., and Jia R.R. Bioorg. Med. Chem. 13 (2005) 5819-5825
15. Pan X.L., Tan N.H., Zeng G.Z., Han H.J., and Huang H.Q. Bioorg. Med. Chem. 14 (2006) 2771-2778