{"id":593,"date":"2019-05-21T08:23:26","date_gmt":"2019-05-20T23:23:26","guid":{"rendered":"https:\/\/www.insilico.jp\/blog\/?p=593"},"modified":"2022-06-29T16:28:28","modified_gmt":"2022-06-29T07:28:28","slug":"ligandscout_dual_inhibitor_screening","status":"publish","type":"post","link":"https:\/\/www.insilico.jp\/blog\/2019\/05\/21\/ligandscout_dual_inhibitor_screening\/","title":{"rendered":"LigandScout\u3067dual inhibitor\u306e\u30b9\u30af\u30ea\u30fc\u30cb\u30f3\u30b0"},"content":{"rendered":"\n<p>\u4eca\u56de\u306f\u3001LigandScout\u3092\u4f7f\u3063\u305fdual inhibitor\u306e\u30b9\u30af\u30ea\u30fc\u30cb\u30f3\u30b0\u306b\u95a2\u3059\u308b\u4ee5\u4e0b\u306e\u6587\u732e\u3092\u7d39\u4ecb\u3057\u305f\u3044\u3068\u601d\u3044\u307e\u3059\u3002\u307e\u305f\u3001\u5b9f\u969b\u306b\u6587\u732e\u306e\u4e00\u90e8\u3092\u30c8\u30ec\u30fc\u30b9\u3057\u305f\u3044\u3068\u601d\u3044\u307e\u3059\u3002\u305f\u3060\u3057LigandScout\u306e\u30d0\u30fc\u30b8\u30e7\u30f3\u306e\u9055\u3044\u306a\u3069\u304c\u3042\u308a\u3001\u5168\u304f\u540c\u3058\u3088\u3046\u306b\u306f\u30c8\u30ec\u30fc\u30b9\u3067\u304d\u3066\u3044\u307e\u305b\u3093\u306e\u3067\u3001\u305d\u306e\u70b9\u306f\u3054\u4e86\u627f\u304f\u3060\u3055\u3044\u3002<br><\/p>\n\n\n\n<p><strong>Discovery of the first dual inhibitor of the 5-lipoxygenase-activating protein and soluble epoxide hydrolase using pharmacophore-based virtual screening.<\/strong><br>Temml V, Garscha U, Romp E, Schubert G, Gerstmeier J, Kutil Z, Matuszczak B, Waltenberger B, Stuppner H, Werz O, Schuster D.<br>Sci Rep. 2017 Feb 20;7:42751. doi: <a href=\"https:\/\/www.nature.com\/articles\/srep42751\">10.1038\/srep42751<\/a><br><\/p>\n\n\n\n<!--more-->\n\n\n\n<p style=\"text-align:left\">One-drug-hits-one-target approach\u306f\u91cd\u8981\u306a\u6226\u7565\u306a\u306e\u3067\u3059\u304c\u3001\u8fd1\u5e74\u306f\u3001<br>polypharmacological approach\u3082\u6ce8\u76ee\u3055\u308c\u3066\u3044\u307e\u3059\u3002\u3053\u3053\u3067\u5927\u5207\u306a\u3053\u3068\u306f\u8907\u6570\u306e\u6a19\u7684\u30bf\u30f3\u30d1\u30af\u8cea\u3092\uff11\u5264\u3067\u963b\u5bb3\u3059\u308b\u305f\u3081\u306e\u8a2d\u8a08\u624b\u6cd5\u3060\u3068\u3044\u3048\u307e\u3059\u3002<br>\u672c\u6587\u732e\u3067\u306f\u3001\u708e\u75c7\u306b\u304b\u304b\u308f\u308b\uff12\u3064\u306e\u30bf\u30f3\u30d1\u30af\u8cea\u30015-lipoxygenase-activating protein (FLAP) \u3068soluble epoxide hydrolase (sEH) \u3092\u5171\u306b\u963b\u5bb3\u3059\u308b\u5316\u5408\u7269\u306e\u63a2\u7d22\u3092LigandScout\u3092\u7528\u3044\u3066\u5b9f\u65bd\u3057\u3066\u3044\u307e\u3059\u3002<br><\/p>\n\n\n\n<p>\u8457\u8005\u3089\u306f\u3001\u4e0b\u56f3\u306b\u793a\u3059\u65e2\u5b58\u306e11\u500b\u306eFLAP\u963b\u5bb3\u5264\u3092\u7528\u3044\u3066\u30d5\u30a1\u30fc\u30de\u30b3\u30d5\u30a9\u30a2\u306e\u69cb\u7bc9\u3068\u30c6\u30b9\u30c8\u3092\u884c\u3063\u3066\u3044\u307e\u3059\u3002<\/p>\n\n\n\n<figure class=\"wp-block-image\"><img loading=\"lazy\" decoding=\"async\" width=\"517\" height=\"579\" src=\"https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig01-3.png\" alt=\"\" class=\"wp-image-601\" srcset=\"https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig01-3.png 517w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig01-3-268x300.png 268w\" sizes=\"auto, (max-width: 517px) 100vw, 517px\" \/><\/figure>\n\n\n\n<p>\u6587\u732e\u3067\u306f\u30012\u7a2e\u985e\u306e\u30d5\u30a1\u30fc\u30de\u30b3\u30d5\u30a9\u30a2\u30e2\u30c7\u30eb\u3001Flap1,\u3068Flap2\u3092\u69cb\u7bc9\u3057\u3066\u3044\u307e\u3059\u3002Flap1\u306fS10,S11\u3092\u7528\u3044\u3066\u3001\u305d\u3057\u3066Flap2\u306fS07,S08,S09\u3092\u7528\u3044\u3066\u69cb\u7bc9\u3055\u308c\u3066\u3044\u307e\u3059\u3002<br>\u672c\u8a18\u4e8b\u3067\u306f\u3001Flap2\u306e\u69cb\u7bc9\u3092\u884c\u3044\u305f\u3044\u3068\u601d\u3044\u307e\u3059\u3002\u672c\u6587\u732e\u3067\u7528\u3044\u3089\u308c\u3066\u3044\u308bLigandScout\u306e\u30d0\u30fc\u30b8\u30e7\u30f3\u306f\u30013.12\u3067\u3059\u304c\u3001\u672c\u8a18\u4e8b\u3067\u306f\u30014.3\u3068\u306a\u308a\u307e\u3059\u3002<\/p>\n\n\n\n<p><strong>\u30d5\u30a1\u30fc\u30de\u30b3\u30d5\u30a9\u30a2\u30e2\u30c7\u30ebFlap2\u306e\u69cb\u7bc9\uff1a<\/strong><br>LigandScout\u3092\u8d77\u52d5\u3057\u3001&#8221;Ligand-Based&#8221; Perspective\u306b\u79fb\u52d5\u3057\u307e\u3059\u3002<br>&#8220;Ligand-Set&#8221;\u2192&#8221;Add Molecules&#8221;\u2192&#8221;To Test-Set&#8221;\u304b\u3089Sall.sdf\u3092\u9078\u629e\u3057\u307e\u3059\u3002<br>Sall.sdf\u306b\u306f\u3001S01\u304b\u3089S11\u306e\u5316\u5408\u7269\u304c\u5165\u3063\u3066\u3044\u307e\u3059\u3002<br>S07,S08,S09\u304b\u3089\u30d5\u30a1\u30fc\u30de\u30b3\u30d5\u30a9\u30a2\u30e2\u30c7\u30eb\u3092\u4f5c\u6210\u3057\u305f\u3044\u306e\u3067\u3001\u3053\u306e\uff13\u3064\u3092Training\u3068\u8a2d\u5b9a\u3057\u307e\u3059\u3002<\/p>\n\n\n\n<figure class=\"wp-block-image\"><img loading=\"lazy\" decoding=\"async\" width=\"1024\" height=\"266\" src=\"https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig02-3-1024x266.png\" alt=\"\" class=\"wp-image-602\" srcset=\"https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig02-3-1024x266.png 1024w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig02-3-300x78.png 300w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig02-3-768x199.png 768w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig02-3-600x156.png 600w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig02-3.png 1960w\" sizes=\"auto, (max-width: 1024px) 100vw, 1024px\" \/><\/figure>\n\n\n\n<p>\u9752\u56db\u89d2\u3092\u62bc\u3057\u3066\u3001\u914d\u5ea7\u751f\u6210\u3092\u884c\u3044\u3001\u8d64\u56db\u89d2\u3092\u62bc\u3057\u3066\u30d5\u30a1\u30fc\u30de\u30b3\u30d5\u30a9\u30a2\u30e2\u30c7\u30eb\u3092\u69cb\u7bc9\u3057\u307e\u3059\u3002Scoring function\u306f&#8221;Pharmacophore-Fit&#8221;\u3001Pharmacophore type\u306f&#8221;Shared feature pharmacophore&#8221;\u3092\u9078\u629e\u3057\u307e\u3057\u305f\u3002<\/p>\n\n\n\n<p>\u4e0b\u56f3\u306e\u3088\u3046\u306a\u30d5\u30a1\u30fc\u30de\u30b3\u30d5\u30a9\u30a2\u30e2\u30c7\u30eb\u304c\u751f\u6210\u3055\u308c\u307e\u3057\u305f\u3002\u672c\u6587\u732e\u306eFig.1B\u3092\u898b\u306a\u304c\u3089Feature\u3092\u9078\u5225\u3057\u307e\u3057\u305f\u3002<\/p>\n\n\n\n<figure class=\"wp-block-image\"><img loading=\"lazy\" decoding=\"async\" width=\"1024\" height=\"860\" src=\"https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig03-3-1024x860.png\" alt=\"\" class=\"wp-image-603\" srcset=\"https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig03-3-1024x860.png 1024w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig03-3-300x252.png 300w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig03-3-768x645.png 768w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig03-3-600x504.png 600w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig03-3.png 1740w\" sizes=\"auto, (max-width: 1024px) 100vw, 1024px\" \/><\/figure>\n\n\n\n<p>\u6392\u9664\u4f53\u7a4d\u3067\u3059\u304c\u3001\u5316\u5408\u7269S01\u304b\u3089S11\u3092\u9078\u629e\u3057\u305f\u72b6\u614b\u3067&#8221;Pharmacophore&#8221;\u2192&#8221;Add Exclusion Volumes Coat&#8221;\u306b\u3088\u308a\u8ffd\u52a0\u3092\u3057\u307e\u3057\u305f\u3002\u3053\u306e\u64cd\u4f5c\u306f\u672c\u6587\u732e\u3068\u306f\u7570\u306a\u308b\u304b\u3082\u3057\u308c\u307e\u305b\u3093\u3002<\/p>\n\n\n\n<figure class=\"wp-block-image\"><img loading=\"lazy\" decoding=\"async\" width=\"1024\" height=\"868\" src=\"https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig04-1-1024x868.png\" alt=\"\" class=\"wp-image-604\" srcset=\"https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig04-1-1024x868.png 1024w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig04-1-300x254.png 300w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig04-1-768x651.png 768w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig04-1-600x509.png 600w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig04-1.png 1738w\" sizes=\"auto, (max-width: 1024px) 100vw, 1024px\" \/><\/figure>\n\n\n\n<p><strong>\u30d5\u30a1\u30fc\u30de\u30b3\u30d5\u30a9\u30a2\u30e2\u30c7\u30ebFlap2\u306e\u8a55\u4fa1\uff1a<\/strong><br>\u201dLigand-Based&#8221; Perspective\u3067\u69cb\u7bc9\u3057\u305fFlap2\u3092&#8221;Screening&#8221; Perspecitve\u306b\u30b3\u30d4\u30fc\u3057\u307e\u3059\u3002Sall.sdf\u304b\u3089Sall.ldb\u306e\u4f5c\u6210\u3092\u884c\u3063\u305f\u5f8c\u3001Flap\uff12\u3092\u7528\u3044\u3066\u30d5\u30a1\u30fc\u30de\u30b3\u30d5\u30a9\u30a2\u63a2\u7d22\u3057\u305f\u3068\u3053\u308d\u30019\u5316\u5408\u7269(S01,S02,S04,S05,S06,S07,S08,S09,S11)\u304c\u30d2\u30c3\u30c8\u3057\u307e\u3057\u305f\u3002\u672c\u6587\u732e\u306b\u304a\u3044\u3066\u3082Flap2\u306b\u3088\u308a11\u5316\u5408\u7269\u4e2d9\u5316\u5408\u7269\u304c\u30d2\u30c3\u30c8\u3057\u305f\u3068\u8a18\u8f09\u3055\u308c\u3066\u3044\u307e\u3059\u3002<\/p>\n\n\n\n<figure class=\"wp-block-image\"><img loading=\"lazy\" decoding=\"async\" width=\"1024\" height=\"524\" src=\"https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig05-1-1024x524.png\" alt=\"\" class=\"wp-image-605\" srcset=\"https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig05-1-1024x524.png 1024w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig05-1-300x153.png 300w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig05-1-768x393.png 768w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig05-1-600x307.png 600w\" sizes=\"auto, (max-width: 1024px) 100vw, 1024px\" \/><\/figure>\n\n\n\n<p><strong>Compoud 5\u3068Flap2\u306e\u30de\u30c3\u30c1\u30f3\u30b0\uff1a<\/strong><br>\u6587\u732e\u3067\u306f\u3001Flap1\u3068Flap2\u3092\u7528\u3044\u3066\u3001SPECS virtual library (202,920 compounds, version 2012)\u306b\u5bfe\u3057\u3066\u30b9\u30af\u30ea\u30fc\u30cb\u30f3\u30b0\u3092\u884c\u3063\u3066\u3044\u307e\u3059\u3002\u305d\u306e\u5f8c\u3001Flap1\u3067\u30d2\u30c3\u30c8\u3057\u305f10\u5316\u5408\u7269\u3068Flap2\u3067\u30d2\u30c3\u30c8\u3057\u305f10\u5316\u5408\u7269\u3092\u5b9f\u969b\u306e\u30a2\u30c3\u30bb\u30a4\u3067\u8a55\u4fa1\u3092\u884c\u3063\u305f\u3068\u3053\u308d\u3001FLAP\u3068sEH\u3092\u5f37\u304f\u963b\u5bb3\u3059\u308b\u5316\u5408\u7269\u3068\u3057\u3066Compound 5\u304c\u5f97\u3089\u308c\u3066\u3044\u307e\u3059(IC<sub>50<\/sub> FLAP = 0.2uM, IC<sub>50<\/sub> sEH = 0.02uM)\u3002<br>\u3053\u3053\u3067\u306f\u3001\u672c\u8a18\u4e8b\u3067\u4f5c\u6210\u3057\u305fFlap2\u304c\u3001Compound5\u3092\u30d2\u30c3\u30c8\u5316\u5408\u7269\u3068\u3057\u3066\u8a8d\u8b58\u3059\u308b\u304b\u5426\u304b\u3092\u30c1\u30a7\u30c3\u30af\u3057\u3066\u307f\u307e\u3057\u305f\u3002<\/p>\n\n\n\n<figure class=\"wp-block-image\"><img loading=\"lazy\" decoding=\"async\" width=\"800\" height=\"600\" src=\"https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig06-1.png\" alt=\"\" class=\"wp-image-608\" srcset=\"https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig06-1.png 800w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig06-1-300x225.png 300w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig06-1-768x576.png 768w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig06-1-600x450.png 600w\" sizes=\"auto, (max-width: 800px) 100vw, 800px\" \/><\/figure>\n\n\n\n<p>&#8220;Screening&#8221; Perspective\u3067\u78ba\u8a8d\u3057\u305f\u306e\u3067\u3059\u304c\u3001Compound 5\u3092\u8a8d\u8b58\u3059\u308b\u3053\u3068\u304c\u3067\u304d\u307e\u3057\u305f\u3002<\/p>\n\n\n\n<p><strong>Compound 5\u3068sEH\u30d5\u30a1\u30fc\u30de\u30b3\u30d5\u30a9\u30a2\u30e2\u30c7\u30eb\u3068\u306e\u30de\u30c3\u30c1\u30f3\u30b0\uff1a<\/strong><br>\u672c\u6587\u732e\u3067\u7528\u3044\u3066\u3044\u308bsEH\u30d5\u30a1\u30fc\u30de\u30b3\u30d5\u30a9\u30a2\u30e2\u30c7\u30eb\u306f\u3001\u5225\u306e\u6587\u732e\u3067\u4f5c\u6210\u3055\u308c\u305f\u3082\u306e\u304c\u5229\u7528\u3055\u308c\u3066\u3044\u307e\u3059\u3002<br>\u672c\u8a18\u4e8b\u3067\u306f\u3001\u672c\u6587\u732e\u4e2d\u306eFig.4A,B\u3092\u898b\u306a\u304c\u3089\u3001sEH\u30d5\u30a1\u30fc\u30de\u30b3\u30d5\u30a9\u30a2\u30e2\u30c7\u30eb\u3092\u69cb\u7bc9\u3057\u3001Compound 5\u3068\u306e\u30de\u30c3\u30c1\u30f3\u30b0\u3092\u78ba\u8a8d\u3057\u307e\u3057\u305f\u3002<br>&#8220;Structure-Based&#8221; Perspective\u306b\u304a\u3044\u3066\u3001sEH\u306ePDB code 3ant\u3092\u5165\u529b\u3057\u307e\u3059\u3002\u9ec4\u8272\u30dc\u30c3\u30af\u30b9\u3067\u56f2\u307e\u308c\u305f\u963b\u5bb3\u5264\u3092\u30af\u30ea\u30c3\u30af\u3057\u3001\u30d5\u30a1\u30fc\u30de\u30b3\u30d5\u30a9\u30a2\u751f\u6210\u3092\u884c\u3044\u307e\u3059\u3002\u4ee5\u4e0b\u306e\u69d8\u306a\u30d5\u30a1\u30fc\u30de\u30b3\u30d5\u30a9\u30a2\u304c\u5f97\u3089\u308c\u307e\u3059\u3002<\/p>\n\n\n\n<figure class=\"wp-block-image\"><img loading=\"lazy\" decoding=\"async\" width=\"800\" height=\"600\" src=\"https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig07-1.png\" alt=\"\" class=\"wp-image-609\" srcset=\"https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig07-1.png 800w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig07-1-300x225.png 300w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig07-1-768x576.png 768w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig07-1-600x450.png 600w\" sizes=\"auto, (max-width: 800px) 100vw, 800px\" \/><\/figure>\n\n\n\n<p>Compound 5\u3068\u672csEH\u30d5\u30a1\u30fc\u30de\u30b3\u30d5\u30a9\u30a2\u30e2\u30c7\u30eb\u306e\u30de\u30c3\u30c1\u30f3\u30b0\u3092\u884c\u3044\u307e\u3057\u305f\u3002<\/p>\n\n\n\n<figure class=\"wp-block-image\"><img loading=\"lazy\" decoding=\"async\" width=\"800\" height=\"600\" src=\"https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig08-1.png\" alt=\"\" class=\"wp-image-610\" srcset=\"https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig08-1.png 800w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig08-1-300x225.png 300w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig08-1-768x576.png 768w, https:\/\/www.insilico.jp\/blog\/wp-content\/uploads\/2019\/05\/Fig08-1-600x450.png 600w\" sizes=\"auto, (max-width: 800px) 100vw, 800px\" \/><\/figure>\n\n\n\n<p>\u8d64\u77e2\u5370\u306eFeature\u3092\u7121\u8996\u3059\u308b\u3068\u6587\u732e\u4e2d\u306eFig.4B\u306b\u8fd1\u3044\u56f3\u304c\u5f97\u3089\u308c\u307e\u3057\u305f\u3002<\/p>\n\n\n\n<p>\u30d5\u30a1\u30fc\u30de\u30b3\u30d5\u30a9\u30a2\u3092\u7528\u3044\u305fdual inhibitor\u306e\u63a2\u7d22\u306f\u3001polypharmacological approach\u3092\u5c55\u958b\u3059\u308b\u4e0a\u3067\u5408\u7406\u7684\u306a\u624b\u6bb5\u306e\uff11\u3064\u3060\u3068\u8a00\u3048\u307e\u3059\u3002<br>\u672c\u8a18\u4e8b\u3067\u306f\u3001\u6587\u732e\u306e\u5185\u5bb9\u3092\u6b63\u78ba\u306b\u30c8\u30ec\u30fc\u30b9\u306f\u51fa\u6765\u3066\u3044\u307e\u305b\u3093\u304c\u3001\u3053\u3053\u3067\u69cb\u7bc9\u3057\u305f\u30d5\u30a1\u30fc\u30de\u30b3\u30d5\u30a9\u30a2\u306fFLAP\u963b\u5bb3\u5264\u306e\u63a2\u7d22\u306b\u5229\u7528\u3067\u304d\u308b\u3068\u601d\u308f\u308c\u307e\u3059\u3002<br>\u6b21\u56de\u3001\u672c\u8a18\u4e8b\u3067\u69cb\u7bc9\u3057\u305f\u30d5\u30a1\u30fc\u30de\u30b3\u30d5\u30a9\u30a2\u3092\u7528\u3044\u3066\u3001SPECS virtual library\u306b\u5bfe\u3059\u308b\u30d5\u30a1\u30fc\u30de\u30b3\u30d5\u30a9\u30a2\u63a2\u7d22\u3092\u5b9f\u969b\u306b\u3084\u3063\u3066\u307f\u305f\u3044\u3068\u601d\u3063\u3066\u3044\u307e\u3059\u3002<br><\/p>\n","protected":false},"excerpt":{"rendered":"<p>\u4eca\u56de\u306f\u3001LigandScout\u3092\u4f7f\u3063\u305fdual inhibitor\u306e\u30b9\u30af\u30ea\u30fc\u30cb\u30f3\u30b0\u306b\u95a2\u3059\u308b\u4ee5\u4e0b\u306e\u6587\u732e\u3092\u7d39\u4ecb\u3057\u305f\u3044\u3068\u601d\u3044\u307e\u3059\u3002\u307e\u305f\u3001\u5b9f\u969b\u306b\u6587\u732e\u306e\u4e00\u90e8\u3092\u30c8\u30ec\u30fc\u30b9\u3057\u305f\u3044\u3068\u601d\u3044\u307e\u3059\u3002\u305f\u3060\u3057LigandScout\u306e\u30d0\u30fc\u30b8\u30e7\u30f3\u306e\u9055\u3044&#8230;<\/p>\n","protected":false},"author":3,"featured_media":0,"comment_status":"closed","ping_status":"closed","sticky":false,"template":"","format":"standard","meta":{"footnotes":""},"categories":[10],"tags":[85,60],"class_list":["post-593","post","type-post","status-publish","format-standard","hentry","category-ligandscout","tag-dual-inhibitor","tag-pharmacophore"],"yoast_head":"<!-- This site is optimized with the Yoast SEO plugin v25.3.1 - https:\/\/yoast.com\/wordpress\/plugins\/seo\/ -->\n<title>LigandScout\u3067dual 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