{"id":2976,"date":"2024-01-20T17:31:44","date_gmt":"2024-01-20T08:31:44","guid":{"rendered":"https:\/\/u-lab.my-pharm.ac.jp\/~mminfo\/?p=2976"},"modified":"2026-01-07T14:59:38","modified_gmt":"2026-01-07T05:59:38","slug":"%e5%8c%96%e5%ad%a6%e6%a7%8b%e9%80%a0%e3%81%ab%e3%82%88%e3%82%8b%e5%a4%89%e7%95%b0%e5%8e%9f%e6%80%a7%e4%ba%88%e6%b8%ac%ef%bc%91%ef%bc%96%ef%bc%9ain-silico%e5%a4%89%e7%95%b0%e5%8e%9f%e6%80%a7%e4%ba%88","status":"publish","type":"post","link":"https:\/\/u-lab2.my-pharm.ac.jp\/~mminfo\/blog\/2976\/","title":{"rendered":"\u5316\u5b66\u69cb\u9020\u306b\u3088\u308b\u5909\u7570\u539f\u6027\u4e88\u6e2c\uff11\uff16\uff1ain silico\u5909\u7570\u539f\u6027\u4e88\u6e2c\u306e\u5230\u9054\u70b9"},"content":{"rendered":"\n<p><a href=\"https:\/\/academic.oup.com\/mutage\/article\/34\/1\/3\/5142926?login=true\">\u7b2c\uff11\u56de<\/a>\uff06<a href=\"https:\/\/www.tandfonline.com\/doi\/full\/10.1080\/1062936X.2023.2284902\">\u7b2c\uff12\u56de<\/a>Ames\/QSAR\u56fd\u969b\u30c1\u30e3\u30ec\u30f3\u30b8\u30d7\u30ed\u30b8\u30a7\u30af\u30c8\u306b\u63d0\u51fa\u3055\u308c\u305f109\u7a2e\u985e\u306e\u4e88\u6e2c\u7d50\u679c\u3092\u96c6\u8a08\u3057\u3001\u5316\u5408\u7269\u306e\u30ab\u30d0\u30fc\u7387\u304c100%\u3060\u3063\u305f\u3068\u304d\u306e\u4e88\u6e2c\u6027\u80fd\u3092\u63a8\u5b9a\u3057\u305f\u7d50\u679c\u3001\u79c1\u305f\u3061\u660e\u6cbb\u85ac\u79d1\u5927\u5b66\u306e\u30b0\u30eb\u30fc\u30d7\u304c\u63d0\u51fa\u3057\u305f<strong><span style=\"color: #0000ff;\">MMI-STK1\u304c<a href=\"https:\/\/u-lab2.my-pharm.ac.jp\/~mminfo\/wordpress\/blog\/2902\/\">\u6700\u3082\u512a\u79c0\u306a\u30e2\u30c7\u30eb<\/a><\/span><\/strong>\u3060\u3063\u305f\u3001\u3068\u3044\u3046\u304a\u8a71\u3092\u3057\u3066\u304d\u307e\u3057\u305f\u3002<br>\n \u3061\u306a\u307f\u306b\u3001MMI-STK1\u306eMMI\u3068\u3044\u3046\u306e\u306f\u79c1\u305f\u3061\u306e\u7814\u7a76\u5ba4\u540d\u3067\u3042\u308b\u533b\u7642\u5206\u5b50\u89e3\u6790\u5b66\uff08Medical Molecular Informatics\uff09\u3092\u610f\u5473\u3057\u3066\u3044\u307e\u3059\u3002STK1\u3068\u3044\u3046\u306e\u306f\u591a\u6570\u306e\u6a5f\u68b0\u5b66\u7fd2\u306e\u30b9\u30bf\u30c3\u30ad\u30f3\u30b0\u30e2\u30c7\u30eb\u3068\u3044\u3046\u3053\u3068\u3067\u3059\u3002<\/p>\n\n\n\n<p>&nbsp;<\/p>\n\n\n\n<p><strong><span style=\"color: #0000ff;\">MMI-STK1\u306f\u3082\u3068\u3082\u3068\u30ab\u30d0\u30fc\u7387100%\u306e\u6761\u4ef6\u3067\u4e88\u6e2c\u7d50\u679c\u3092\u63d0\u51fa\u3057\u3066\u3044\u307e\u3057\u305f\u304c\u3001\u3082\u3057\u30ab\u30d0\u30fc\u7387\u3092\u8a2d\u5b9a\u3057\u305f\u3089\u4e88\u6e2c\u6027\u80fd\u306f\u3055\u3089\u306b\u5411\u4e0a\u3059\u308b\u53ef\u80fd\u6027\u304c\u3042\u308a\u307e\u3059\u3002<\/span><\/strong><br>\n \u305d\u3053\u3067\u3001\u4eca\u5ea6\u306f<strong><span style=\"color: #ff0000;\">\u30ab\u30d0\u30fc\u7387\u306e\u63a8\u79fb\u306b\u3088\u3063\u3066\u4e88\u6e2c\u6027\u80fd\u304c\u3069\u306e\u3088\u3046\u306b\u5909\u52d5\u3059\u308b\u306e\u304b<\/span><\/strong>\u3092\u63a8\u5b9a\u3057\u3066\u307f\u305f\u3044\u3068\u601d\u3044\u307e\u3059\u3002<br>\n \u306a\u304a\u3001MMI-STK1\u306e\u3088\u3046\u306aQSAR\u30e2\u30c7\u30eb\u306e\u5834\u5408\u306f\u9069\u7528\u9818\u57df\u3092\u9069\u5207\u306b\u8a2d\u5b9a\u3059\u308b\u3053\u3068\u306b\u3088\u3063\u3066\u4e88\u6e2c\u6027\u80fd\u3092\u5411\u4e0a\u3055\u305b\u308b\u3053\u3068\u304c\u3067\u304d\u307e\u3059\u3002<br>\n \u4e00\u65b9\u3001\u4e0d\u9069\u5207\u306a\u9069\u7528\u9818\u57df\u3092\u4f7f\u7528\u3059\u308b\u3068\u9006\u306b\u6027\u80fd\u304c\u52a3\u5316\u3059\u308b\u3053\u3068\u3082\u3042\u308a\u5f97\u307e\u3059\u3002<br>\n \u3053\u3053\u3067\u306f\u3001\u7b2c\uff11\u56de\uff06\u7b2c\uff12\u56de\u30d7\u30ed\u30b8\u30a7\u30af\u30c8\u306b\u304a\u3044\u3066\u30ab\u30d0\u30fc\u7387\u3092\u8a2d\u5b9a\u3057\u305f\u5168\u3066\u306e\u4e88\u6e2c\u30e2\u30c7\u30eb\u304b\u3089\u5f97\u3089\u308c\u308b\u5e73\u5747\u7684\u306a\u9069\u7528\u9818\u57df\u306e\u5f71\u97ff\u3092\u89e3\u6790\u306b\u4f7f\u7528\u3057\u307e\u3059\u3002<\/p>\n\n\n\n<p>\u30ab\u30d0\u30fc\u7387\u306b\u3088\u3063\u3066\u4e88\u6e2c\u6027\u80fd\u306e\u8a55\u4fa1\u6307\u6a19\uff08\u30d0\u30e9\u30f3\u30b9\u7cbe\u5ea6\u3001MCC\u3001F1\u30b9\u30b3\u30a2\u3001PC1\uff09\u304c\u3069\u306e\u3088\u3046\u306b\u5909\u52d5\u3057\u3066\u3044\u304f\u306e\u304b\u3092\u63a8\u5b9a\u3059\u308b\u308f\u3051\u3067\u3059\u304c\u3001\u3053\u306e\u89e3\u6790\u306b\u3082\u4ee5\u524d\u3054\u7d39\u4ecb\u3057\u305f<strong><span style=\"color: #0000ff;\">\u6b63\u898f\u5206\u5e03\u5316\u30ab\u30d0\u30fc\u7387\u3068\u5404\u8a55\u4fa1\u6307\u6a19\u306e\u6563\u5e03\u56f3<\/span><\/strong>\u3092\u4f7f\u7528\u3057\u307e\u3059\u3002<br>\n \u3053\u308c\u3089\u306e\u6563\u5e03\u56f3\u3067\u306f\u7d71\u8a08\u7684\u306b\u6709\u610f\u306a\u6700\u5c0f\u4e8c\u4e57\u76f4\u7dda\u304c\u8a2d\u5b9a\u3067\u304d\u307e\u3057\u305f\u306e\u3067\u3001\u3053\u308c\u3089\u306e\u76f4\u7dda\u306e\u50be\u304d\u3092\u4f7f\u3063\u3066\u7a2e\u3005\u30ab\u30d0\u30fc\u7387\u306b\u304a\u3051\u308bMMI-STK1\u306e\u8a55\u4fa1\u6307\u6a19\u3092\u63a8\u5b9a\u3057\u307e\u3059\u3002<br>\n \u3053\u306e\u76f4\u7dda\u304b\u3089\u30ab\u30d0\u30fc\u7387100%\u306e\u3068\u304d\u306e\u5404\u8a55\u4fa1\u6307\u6a19\u3092\u6c42\u3081\u3001\u3053\u308c\u306e\u5e73\u5747\u5024\u3068MMI-STK1\u306e\u8a55\u4fa1\u5024\u306e\u6b8b\u5dee\u3092\u76f4\u7dda\u306b\u8db3\u3057\u5408\u308f\u305b\u308b\u3053\u3068\u306b\u3088\u3063\u3066\u8a08\u7b97\u3057\u307e\u3059\u3002<br>\n \u3053\u306e\u4f5c\u696d\u306f\u3001<strong><span style=\"color: #0000ff;\">\u30ab\u30d0\u30fc\u7387100%\u306e\u3068\u304d\u306eMMI-STK1\u306e\u8a55\u4fa1\u5024\u3092\u76f4\u7dda\u306b\u6cbf\u3063\u3066\u5e73\u884c\u79fb\u52d5\u3055\u305b\u308b<\/span><\/strong>\u3053\u3068\u306b\u76f8\u5f53\u3057\u307e\u3059\uff08\u4e0b\u56f3\u53c2\u7167\uff09\u3002<\/p>\n\n\n\n<figure class=\"wp-block-image size-full\"><img loading=\"lazy\" decoding=\"async\" width=\"717\" height=\"622\" src=\"https:\/\/u-lab2.my-pharm.ac.jp\/~mminfo\/wordpress\/wp-content\/uploads\/image-1.png\" alt=\"\" class=\"wp-image-5054\" srcset=\"https:\/\/u-lab2.my-pharm.ac.jp\/~mminfo\/wordpress\/wp-content\/uploads\/image-1.png 717w, https:\/\/u-lab2.my-pharm.ac.jp\/~mminfo\/wordpress\/wp-content\/uploads\/image-1-300x260.png 300w\" sizes=\"auto, (max-width: 717px) 100vw, 717px\" \/><\/figure>\n\n\n\n<p>\u3053\u306e\u56f3\u306e\u6a2a\u8ef8\u306fJohnson\u306e\u65b9\u6cd5\u3067\u6b63\u898f\u5206\u5e03\u5316\u3055\u308c\u305f\u30ab\u30d0\u30fc\u7387\u3067\u3059\u304c\u3001\u3053\u306e\u5909\u63db\u306f\u975e\u7dda\u5f62\u3067\u3059\u306e\u3067\u308f\u304b\u308a\u306b\u304f\u3044\u3068\u601d\u3044\u307e\u3059\u3002<br>\n \u305d\u3053\u3067\u3001\u6a2a\u8ef8\u3092\u5143\u306e\u30ab\u30d0\u30fc\u7387\u306b\u76f4\u3057\u3066\u63cf\u753b\u3057\u76f4\u3057\u305f\u306e\u304c\u6b21\u306e\u56f3\u3067\u3059\u3002<\/p>\n\n\n\n<figure class=\"wp-block-image size-full\"><img loading=\"lazy\" decoding=\"async\" width=\"801\" height=\"620\" src=\"https:\/\/u-lab2.my-pharm.ac.jp\/~mminfo\/wordpress\/wp-content\/uploads\/image-2.png\" alt=\"\" class=\"wp-image-5055\" srcset=\"https:\/\/u-lab2.my-pharm.ac.jp\/~mminfo\/wordpress\/wp-content\/uploads\/image-2.png 801w, https:\/\/u-lab2.my-pharm.ac.jp\/~mminfo\/wordpress\/wp-content\/uploads\/image-2-300x232.png 300w, https:\/\/u-lab2.my-pharm.ac.jp\/~mminfo\/wordpress\/wp-content\/uploads\/image-2-768x594.png 768w\" sizes=\"auto, (max-width: 801px) 100vw, 801px\" \/><\/figure>\n\n\n\n<p>\u5168\u3066\u306e\u8a55\u4fa1\u6307\u6a19\u306b\u304a\u3044\u3066\u3001<span style=\"color: #0000ff;\"><strong>100\uff05\u304b\u3089\u5c11\u3057\u30ab\u30d0\u30fc\u7387\u3092\u843d\u3068\u3059\u3068\u5927\u5e45\u306b\u6027\u80fd\u304c\u5411\u4e0a\u3057\u3066\u3044\u308b<\/strong><\/span>\u3053\u3068\u304c\u308f\u304b\u308a\u307e\u3059\u3002<br>\n \u4f8b\u3048\u3070\u3001<strong><span style=\"color: #0000ff;\">\u30ab\u30d0\u30fc\u7387100%\u306b\u304a\u3051\u308bMMI-STK1\u306eF1\u30b9\u30b3\u30a2\u306f52.8%\u3067\u3057\u305f\u304c\u3001\u30ab\u30d0\u30fc\u7387\u304c90%\u306b\u306a\u308b\u306859.2%\u307e\u3067\u4e0a\u6607\u3057\u3066\u3044\u307e\u3059<\/span><\/strong>\u3002\u305d\u306e\u5f8c\u306e\u6027\u80fd\u5411\u4e0a\u306f\u306a\u3060\u3089\u304b\u3067\u300160%\u306830%\u306e\u3068\u304d\u306eF1\u30b9\u30b3\u30a2\u306f61.5\u304a\u3088\u307363.1\u3068\u63a8\u5b9a\u3055\u308c\u307e\u3057\u305f\u3002<br>\n \u3053\u306e\u89b3\u5bdf\u306f\u3001<strong><span style=\"background-color: #ffffff; color: #ff0000;\">QSAR\u4e88\u6e2c\u30e2\u30c7\u30eb\u3067\u306f\u4e88\u6e2c\u304c\u56f0\u96e3\u3067\u3042\u3063\u305f\u5c11\u6570\u306e\u5316\u5408\u7269\u304c\u30d6\u30e9\u30a4\u30f3\u30c9\u30c6\u30b9\u30c8\u30bb\u30c3\u30c8\u306e\u4e2d\u306b\u542b\u307e\u308c\u3066\u3044\u305f<\/span><\/strong>\u3053\u3068\u3092\u793a\u5506\u3057\u3066\u3044\u308b\u3068\u8003\u3048\u308b\u3053\u3068\u304c\u3067\u304d\u307e\u3059\u3002<\/p>\n\n\n\n<p><span style=\"background-color: #ccffff;\">\u3053\u306e\u3088\u3046\u306a\u89e3\u6790\u306f\u3001\u4e88\u6e2c\u6027\u80fd\u3068\u30ab\u30d0\u30fc\u7387\u306e\u30d0\u30e9\u30f3\u30b9\u3092\u52d8\u6848\u3059\u308b\u305f\u3081\u306b\u6709\u7528\u306a\u60c5\u5831\u306b\u306a\u308b\u3068\u601d\u3044\u307e\u3059\u3002<\/span><br>\n <span style=\"background-color: #ffffff;\"> 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#ffffff;\">\u3059\u3067\u306b\u5b9f\u6e2c\u5024\u304c\u516c\u958b\u3055\u308c\u3066\u3057\u307e\u3063\u3066\u3044\u308b\u5316\u5408\u7269\u306f\u65e2\u5b58\u306e\u30e2\u30c7\u30eb\u306e\u30c8\u30ec\u30fc\u30cb\u30f3\u30b0\u306b\u4f7f\u7528\u3055\u308c\u3066\u3044\u308b\u53ef\u80fd\u6027\u304c\u3042\u308a\u307e\u3059\u306e\u3067\u3001\u53b3\u5bc6\u306a\u30e2\u30c7\u30eb\u306e\u8a55\u4fa1\u306b\u306f\u4f7f\u7528\u3067\u304d\u307e\u305b\u3093\u3002<\/span><\/p>\n\n\n\n<p><span style=\"background-color: #ffffff;\">\u305d\u306e\u610f\u5473\u3067\u3001\u3053\u306e\u30d7\u30ed\u30b8\u30a7\u30af\u30c8\u306e\u610f\u7fa9\u306f\u6975\u3081\u3066\u5927\u304d\u3044\u3068\u601d\u3044\u307e\u3059\u3002<\/span><\/p>\n\n\n\n<p><span style=\"background-color: #ccffff;\"><span style=\"background-color: 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