{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,3,23]],"date-time":"2026-03-23T10:50:26Z","timestamp":1774263026107,"version":"3.50.1"},"reference-count":39,"publisher":"American Chemical Society (ACS)","issue":"11","content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Chem. Inf. Model."],"published-print":{"date-parts":[[2009,11,23]]},"DOI":"10.1021\/ci900254b","type":"journal-article","created":{"date-parts":[[2009,10,30]],"date-time":"2009-10-30T18:08:55Z","timestamp":1256926135000},"page":"2489-2497","source":"Crossref","is-referenced-by-count":35,"title":["Pharmacophore Modeling for Qualitative Prediction of Antiestrogenic Activity"],"prefix":"10.1021","volume":"49","author":[{"given":"Simone","family":"Brogi","sequence":"first","affiliation":[{"name":"Dipartimento Farmaco Chimico Tecnologico, Universit\u00e0 degli Studi di Siena, Via Aldo Moro, I-53100 Siena, Italy, Department of Pharmacognosy & Chemistry of Natural Products, School of Pharmacy, University of Athens, Panepistimiopolis Zografou, Athens 15771, Greece, and Department of Animal & Human Physiology, School of Sciences, University of Athens, Panepistimiopolis Zografou, Athens 157 84, Greece"}]},{"given":"Maria","family":"Kladi","sequence":"additional","affiliation":[{"name":"Dipartimento Farmaco Chimico Tecnologico, Universit\u00e0 degli Studi di Siena, Via Aldo Moro, I-53100 Siena, Italy, Department of Pharmacognosy & Chemistry of Natural Products, School of Pharmacy, University of Athens, Panepistimiopolis Zografou, Athens 15771, Greece, and Department of Animal & Human Physiology, School of Sciences, University of Athens, Panepistimiopolis Zografou, Athens 157 84, Greece"}]},{"given":"Constantinos","family":"Vagias","sequence":"additional","affiliation":[{"name":"Dipartimento Farmaco Chimico Tecnologico, Universit\u00e0 degli Studi di Siena, Via Aldo Moro, I-53100 Siena, Italy, Department of Pharmacognosy & Chemistry of Natural Products, School of Pharmacy, University of Athens, Panepistimiopolis Zografou, Athens 15771, Greece, and Department of Animal & Human Physiology, School of Sciences, University of Athens, Panepistimiopolis Zografou, Athens 157 84, Greece"}]},{"given":"Panagiota","family":"Papazafiri","sequence":"additional","affiliation":[{"name":"Dipartimento Farmaco Chimico Tecnologico, Universit\u00e0 degli Studi di Siena, Via Aldo Moro, I-53100 Siena, Italy, Department of Pharmacognosy & Chemistry of Natural Products, School of Pharmacy, University of Athens, Panepistimiopolis Zografou, Athens 15771, Greece, and Department of Animal & Human Physiology, School of Sciences, University of Athens, Panepistimiopolis Zografou, Athens 157 84, Greece"}]},{"given":"Vassilios","family":"Roussis","sequence":"additional","affiliation":[{"name":"Dipartimento Farmaco Chimico Tecnologico, Universit\u00e0 degli Studi di Siena, Via Aldo Moro, I-53100 Siena, Italy, Department of Pharmacognosy & Chemistry of Natural Products, School of Pharmacy, University of Athens, Panepistimiopolis Zografou, Athens 15771, Greece, and Department of Animal & Human Physiology, School of Sciences, University of Athens, Panepistimiopolis Zografou, Athens 157 84, Greece"}]},{"given":"Andrea","family":"Tafi","sequence":"additional","affiliation":[{"name":"Dipartimento Farmaco Chimico Tecnologico, Universit\u00e0 degli Studi di Siena, Via Aldo Moro, I-53100 Siena, Italy, Department of Pharmacognosy & Chemistry of Natural Products, School of Pharmacy, University of Athens, Panepistimiopolis Zografou, Athens 15771, Greece, and Department of Animal & Human Physiology, School of Sciences, University of Athens, Panepistimiopolis Zografou, Athens 157 84, Greece"}]}],"member":"316","published-online":{"date-parts":[[2009,10,30]]},"reference":[{"key":"ref1\/cit1","doi-asserted-by":"crossref","first-page":"7606","DOI":"10.1016\/j.tet.2007.05.051","volume":"63","author":"Kladi M.","year":"2007","journal-title":"Tetrahedron"},{"key":"ref2\/cit2","doi-asserted-by":"crossref","first-page":"1696","DOI":"10.1016\/j.tet.2007.12.007","volume":"64","author":"Kontiza I.","year":"2008","journal-title":"Tetrahedron"},{"key":"ref3\/cit3","doi-asserted-by":"crossref","first-page":"190","DOI":"10.1021\/np800481w","volume":"72","author":"Kladi M.","year":"2009","journal-title":"J. Nat. Prod."},{"key":"ref4\/cit4","doi-asserted-by":"crossref","first-page":"3","DOI":"10.1002\/3527609164.ch1","volume-title":"Pharmacophores and Pharmacophore Searches","volume":"32","author":"Wermuth C. G.","year":"2006"},{"key":"ref5\/cit5","doi-asserted-by":"crossref","first-page":"2146","DOI":"10.1021\/ci6002043","volume":"46","author":"Steindl T. M.","year":"2006","journal-title":"J. Chem. Inf. Model."},{"key":"ref6\/cit6","doi-asserted-by":"crossref","first-page":"211","DOI":"10.1007\/978-3-7643-8117-2_6","volume-title":"Natural Compounds as Drugs Volume I","volume":"65","author":"Rollinger J. M.","year":"2008"},{"key":"ref7\/cit7","unstructured":"International Science Forum on Computational Toxicology;http:\/\/www.epa.gov\/comptox\/forum\/(accessed February 14, 2007)."},{"key":"ref8\/cit8","doi-asserted-by":"crossref","first-page":"177","DOI":"10.1016\/j.steroids.2005.09.004","volume":"71","author":"Kontiza I.","year":"2006","journal-title":"Steroids"},{"key":"ref9\/cit9","doi-asserted-by":"crossref","first-page":"17","DOI":"10.1002\/cber.19090420105","volume":"42","author":"Ehrlich P.","year":"1909","journal-title":"Dtsch. Chem. Ges."},{"key":"ref10\/cit10","doi-asserted-by":"crossref","first-page":"463","DOI":"10.1002\/ijc.11237","volume":"106","author":"Perera N. M.","year":"2003","journal-title":"Int. J. Cancer"},{"key":"ref11\/cit11","doi-asserted-by":"crossref","first-page":"39","DOI":"10.1186\/bcr742","volume":"6","author":"Shao W.","year":"2004","journal-title":"Breast Cancer Res."},{"key":"ref12\/cit12","doi-asserted-by":"crossref","first-page":"141","DOI":"10.1111\/j.1749-6632.2009.03688.x","volume":"1155","author":"Dunn B. K.","year":"2009","journal-title":"Ann. N.Y. Acad. Sci."},{"key":"ref13\/cit13","volume-title":"Catalyst","year":"2003"},{"key":"ref14\/cit14","doi-asserted-by":"crossref","first-page":"146","DOI":"10.1021\/jm9606352","volume":"40","author":"Grese T. A.","year":"1997","journal-title":"J. Med. Chem."},{"key":"ref15\/cit15","doi-asserted-by":"crossref","first-page":"884","DOI":"10.1016\/j.jmgm.2007.06.003","volume":"26","author":"Mukherjee S.","year":"2008","journal-title":"J. Mol. Graph. Model."},{"key":"ref16\/cit16","unstructured":"Accelrys, Inc. Accelrys: Catalyst;http:\/\/www.accelrys.com\/products\/catalyst(accessed June 26, 2007)"},{"key":"ref17\/cit17","doi-asserted-by":"crossref","first-page":"1125","DOI":"10.1021\/tx060126v","volume":"19","author":"Dowers T. S.","year":"2006","journal-title":"Chem. Res. Toxicol."},{"key":"ref18\/cit18","doi-asserted-by":"crossref","first-page":"17","DOI":"10.1007\/s10549-005-9083-x","volume":"97","author":"Trafalis D. T. P.","year":"2006","journal-title":"Brest Cancer Res. Treat."},{"key":"ref19\/cit19","doi-asserted-by":"crossref","first-page":"642","DOI":"10.1021\/ci0502956","volume":"46","author":"Firth-Clarck S.","year":"2006","journal-title":"J. Chem. Inf. Model."},{"key":"ref20\/cit20","doi-asserted-by":"crossref","first-page":"2813","DOI":"10.1021\/jm030213+","volume":"46","author":"Kumar S. K.","year":"2003","journal-title":"J. Med. Chem."},{"key":"ref21\/cit21","doi-asserted-by":"crossref","first-page":"3290","DOI":"10.1021\/jm070194u","volume":"50","author":"Gangjee A.","year":"2007","journal-title":"J. Med. Chem."},{"key":"ref22\/cit22","doi-asserted-by":"crossref","first-page":"15106","DOI":"10.1021\/ja047633o","volume":"126","author":"Manas E. S.","year":"2004","journal-title":"J. Am. Chem. Soc."},{"key":"ref23\/cit23","doi-asserted-by":"crossref","first-page":"259","DOI":"10.1016\/j.jsbmb.2007.03.022","volume":"104","author":"Zimmermann J.","year":"2007","journal-title":"J. Steroid Biochem. Mol. Biol."},{"key":"ref24\/cit24","doi-asserted-by":"crossref","first-page":"1611","DOI":"10.1021\/jf0527403","volume":"54","author":"Larrosa M.","year":"2006","journal-title":"J. Agric. Food Chem."},{"key":"ref25\/cit25","doi-asserted-by":"crossref","first-page":"327","DOI":"10.1016\/j.ejmech.2006.10.017","volume":"42","author":"Kode N.","year":"2007","journal-title":"Eur. J. Med. Chem."},{"key":"ref26\/cit26","unstructured":"Kladi, M.Isolation and pharmacological evaluation of bioactive metabolites from the genus Laurencia, Asparagopsis and Falkenbergia. Ph.D. Thesis; University of Athens, Greece, 2006; pp377\u2212384."},{"key":"ref27\/cit27","doi-asserted-by":"crossref","first-page":"3841","DOI":"10.1021\/jm800009r","volume":"51","author":"La Regina G.","year":"2008","journal-title":"J. Med. Chem."},{"key":"ref28\/cit28","doi-asserted-by":"crossref","first-page":"1431","DOI":"10.1016\/j.addr.2006.09.006","volume":"58","author":"Chang C.","year":"2006","journal-title":"Adv. Drug Delivery Rev."},{"key":"ref29\/cit29","doi-asserted-by":"crossref","first-page":"753","DOI":"10.1038\/39645","volume":"389","author":"Brzozowski A. M.","year":"1997","journal-title":"Nature"},{"key":"ref30\/cit30","doi-asserted-by":"crossref","first-page":"2197","DOI":"10.1016\/j.str.2004.09.015","volume":"12","author":"Manas E. S.","year":"2004","journal-title":"Structure"},{"key":"ref31\/cit31","doi-asserted-by":"crossref","first-page":"1512","DOI":"10.1016\/j.bmcl.2009.01.005","volume":"19","author":"Olla S.","year":"2009","journal-title":"Bioorg. Med. Chem. Lett."},{"key":"ref32\/cit32","doi-asserted-by":"crossref","first-page":"3","DOI":"10.1016\/S0169-409X(96)00423-1","volume":"23","author":"Lipinsky C. A.","year":"1997","journal-title":"Adv. Drug Delivery Rev."},{"key":"ref33\/cit33","doi-asserted-by":"crossref","first-page":"43","DOI":"10.1016\/S0022-2836(95)80037-9","volume":"245","author":"Jones G.","year":"1995","journal-title":"J. Mol. Biol."},{"key":"ref34\/cit34","doi-asserted-by":"crossref","first-page":"727","DOI":"10.1006\/jmbi.1996.0897","volume":"267","author":"Jones G.","year":"1997","journal-title":"J. Mol. Biol."},{"key":"ref35\/cit35","unstructured":"Accelrys, Inc. Automated Training Set Selection used for Developing a 3D QSAR Pharmacophore Model in CATALYST;http:\/\/accelrys.com\/references\/case-studies\/training-set-selection.html(accessed September 29, 2009)"},{"key":"ref36\/cit36","doi-asserted-by":"crossref","first-page":"927","DOI":"10.1016\/S0092-8674(00)81717-1","volume":"95","author":"Shiau A.","year":"1998","journal-title":"Cell"},{"key":"ref37\/cit37","volume-title":"Discovery Studio","year":"2007"},{"key":"ref38\/cit38","doi-asserted-by":"crossref","first-page":"55","DOI":"10.1016\/0022-1759(83)90303-4","volume":"65","author":"Mosmann T.","year":"1983","journal-title":"J. Immunol. Methods"},{"key":"ref39\/cit39","first-page":"589","volume":"48","author":"Alley M. C.","year":"1988","journal-title":"Cancer Res."}],"container-title":["Journal of Chemical Information and Modeling"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/ci900254b","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2023,3,9]],"date-time":"2023-03-09T14:11:38Z","timestamp":1678371098000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/ci900254b"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2009,10,30]]},"references-count":39,"journal-issue":{"issue":"11","published-print":{"date-parts":[[2009,11,23]]}},"alternative-id":["10.1021\/ci900254b"],"URL":"https:\/\/doi.org\/10.1021\/ci900254b","relation":{},"ISSN":["1549-9596","1549-960X"],"issn-type":[{"value":"1549-9596","type":"print"},{"value":"1549-960X","type":"electronic"}],"subject":[],"published":{"date-parts":[[2009,10,30]]}}}