{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,8,17]],"date-time":"2026-08-17T14:50:53Z","timestamp":1786978253303,"version":"build-2736575974"},"reference-count":35,"publisher":"Wiley","issue":"8-9","license":[{"start":{"date-parts":[[2019,4,10]],"date-time":"2019-04-10T00:00:00Z","timestamp":1554854400000},"content-version":"vor","delay-in-days":0,"URL":"http:\/\/onlinelibrary.wiley.com\/termsAndConditions#vor"}],"funder":[{"DOI":"10.13039\/501100012226","name":"Fundamental Research Funds for the Central Universities","doi-asserted-by":"publisher","award":["Lzujbky-2018-136"],"award-info":[{"award-number":["Lzujbky-2018-136"]}],"id":[{"id":"10.13039\/501100012226","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100012226","name":"Fundamental Research Funds for the Central Universities","doi-asserted-by":"publisher","award":["lzujbky-2017-203"],"award-info":[{"award-number":["lzujbky-2017-203"]}],"id":[{"id":"10.13039\/501100012226","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":["onlinelibrary.wiley.com"],"crossmark-restriction":true},"short-container-title":["Molecular Informatics"],"published-print":{"date-parts":[[2019,8]]},"abstract":"<jats:title>Abstract<\/jats:title>\n                  <jats:p>\n                    Androgen receptor (AR), a member of the nuclear hormone receptor superfamily of intracellular ligand\u2010dependent transcription factors, plays an indispensable role in normal male development through the regulation of androgen through the binding with endogenous androgens. Inappropriate amounts of androgens have a severe adverse effect on men. Excessive androgen may contribute to accelerate prostatic hypertrophy, even prostate cancer, while the absence of androgen may result in reduced muscle mass and strength, decreased bone mass, low energy, diminished sexual function and an increased risk of osteoporosis and fracture. In these cases, androgen receptor modulators are important to maintain the normal biological function of AR. So androgen receptor modulators are necessary for human being to improve their happy life index. To explore the relationships between molecular structures and corresponding binding abilities to aid the new AR modulator design, multiple linear regressions (MLR) are employed to analyze a series of hydantoin analogues, which can bind to androgen receptor acting as AR modulators. The obtained optimum model presents wonderful reliabilities and strong predictive abilities with R\n                    <jats:sup>2<\/jats:sup>\n                    =0.858,\n                    <jats:inline-graphic xmlns:xlink=\"http:\/\/www.w3.org\/1999\/xlink\" xlink:href=\"graphic\/minf201800147-math-0001.png\" xlink:title=\"urn:x-wiley:18681743:media:minf201800147:minf201800147-math-0001\"\/>\n                    =0.822,\n                    <jats:inline-graphic xmlns:xlink=\"http:\/\/www.w3.org\/1999\/xlink\" xlink:href=\"graphic\/minf201800147-math-0002.png\" xlink:title=\"urn:x-wiley:18681743:media:minf201800147:minf201800147-math-0002\"\/>\n                    =0.813,\n                    <jats:inline-graphic xmlns:xlink=\"http:\/\/www.w3.org\/1999\/xlink\" xlink:href=\"graphic\/minf201800147-math-0003.png\" xlink:title=\"urn:x-wiley:18681743:media:minf201800147:minf201800147-math-0003\"\/>\n                    =0.840,\n                    <jats:inline-graphic xmlns:xlink=\"http:\/\/www.w3.org\/1999\/xlink\" xlink:href=\"graphic\/minf201800147-math-0004.png\" xlink:title=\"urn:x-wiley:18681743:media:minf201800147:minf201800147-math-0004\"\/>\n                    =0.807,\n                    <jats:inline-graphic xmlns:xlink=\"http:\/\/www.w3.org\/1999\/xlink\" xlink:href=\"graphic\/minf201800147-math-0005.png\" xlink:title=\"urn:x-wiley:18681743:media:minf201800147:minf201800147-math-0005\"\/>\n                    =0.814, CCC=0.893, respectively. The derived model can be used to predict the binding abilities of unknown chemicals and may help to design novel molecules with better AR affinity activity.\n                  <\/jats:p>","DOI":"10.1002\/minf.201800147","type":"journal-article","created":{"date-parts":[[2019,4,10]],"date-time":"2019-04-10T08:44:45Z","timestamp":1554885885000},"update-policy":"https:\/\/doi.org\/10.1002\/crossmark_policy","source":"Crossref","is-referenced-by-count":1,"title":["QSAR Analysis of a Series of Hydantoin\u2010based Androgen Receptor Modulators and Corresponding Binding Affinities"],"prefix":"10.1002","volume":"38","author":[{"given":"Xin","family":"Wang","sequence":"first","affiliation":[{"name":"School of Pharmacy Lanzhou University  199 West Donggang Rd. 730000 Lanzhou China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Wenya","family":"Han","sequence":"additional","affiliation":[{"name":"School of Pharmacy Lanzhou University  199 West Donggang Rd. 730000 Lanzhou China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Jiazhong","family":"Li","sequence":"additional","affiliation":[{"name":"School of Pharmacy Lanzhou University  199 West Donggang Rd. 730000 Lanzhou China"}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"311","published-online":{"date-parts":[[2019,4,10]]},"reference":[{"key":"e_1_2_7_2_1","doi-asserted-by":"publisher","DOI":"10.1210\/er.2004-0013"},{"key":"e_1_2_7_3_1","doi-asserted-by":"publisher","DOI":"10.1093\/gerona\/57.2.M76"},{"key":"e_1_2_7_4_1","doi-asserted-by":"publisher","DOI":"10.1016\/0026-0495(83)90002-1"},{"key":"e_1_2_7_5_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.jep.2018.09.009"},{"key":"e_1_2_7_6_1","author":"Nigam A.","year":"2018","journal-title":"BMJ case reports"},{"key":"e_1_2_7_7_1","doi-asserted-by":"publisher","DOI":"10.1517\/14728222.2015.1075511"},{"key":"e_1_2_7_8_1","doi-asserted-by":"publisher","DOI":"10.1056\/NEJMra022251"},{"key":"e_1_2_7_9_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.urolonc.2018.06.004"},{"key":"e_1_2_7_10_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.bmcl.2004.09.049"},{"key":"e_1_2_7_11_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.bmcl.2007.01.076"},{"key":"e_1_2_7_12_1","doi-asserted-by":"publisher","DOI":"10.1021\/jm070312d"},{"key":"e_1_2_7_13_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.bmcl.2008.02.006"},{"key":"e_1_2_7_14_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.bmcl.2004.10.085"},{"key":"e_1_2_7_15_1","doi-asserted-by":"publisher","DOI":"10.1021\/jm061101w"},{"key":"e_1_2_7_16_1","unstructured":"HyperChem 7.0 Hypercube Inc2002."},{"key":"e_1_2_7_17_1","unstructured":"DRAGON for Windows (Software for molecular Descriptor Calculation) Version 5.5-Talete srl http:\/\/www.talete.mi.it2007."},{"key":"e_1_2_7_18_1","doi-asserted-by":"publisher","DOI":"10.1023\/A:1027284627085"},{"key":"e_1_2_7_19_1","doi-asserted-by":"publisher","DOI":"10.1021\/ci015504a"},{"key":"e_1_2_7_20_1","doi-asserted-by":"publisher","DOI":"10.1002\/9783527613106"},{"key":"e_1_2_7_21_1","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.23361"},{"key":"e_1_2_7_22_1","doi-asserted-by":"publisher","DOI":"10.1021\/ci990010n"},{"key":"e_1_2_7_23_1","doi-asserted-by":"publisher","DOI":"10.1007\/s11030-010-9268-z"},{"key":"e_1_2_7_24_1","doi-asserted-by":"publisher","DOI":"10.1007\/s11030-009-9212-2"},{"key":"e_1_2_7_25_1","doi-asserted-by":"publisher","DOI":"10.1021\/tx0601509"},{"key":"e_1_2_7_26_1","doi-asserted-by":"publisher","DOI":"10.1039\/b923843c"},{"key":"e_1_2_7_27_1","doi-asserted-by":"publisher","DOI":"10.1590\/S0103-50532009000400021"},{"key":"e_1_2_7_28_1","doi-asserted-by":"publisher","DOI":"10.1021\/ci700157b"},{"key":"e_1_2_7_29_1","first-page":"69","volume":"22","author":"Tropsha A.","year":"2003","journal-title":"Mol. 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