{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,7,13]],"date-time":"2026-07-13T15:07:26Z","timestamp":1783955246155,"version":"3.55.0"},"reference-count":51,"publisher":"American Chemical Society (ACS)","issue":"10","license":[{"start":{"date-parts":[[2021,9,23]],"date-time":"2021-09-23T00:00:00Z","timestamp":1632355200000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-029"},{"start":{"date-parts":[[2021,9,23]],"date-time":"2021-09-23T00:00:00Z","timestamp":1632355200000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-037"},{"start":{"date-parts":[[2021,9,23]],"date-time":"2021-09-23T00:00:00Z","timestamp":1632355200000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-045"}],"funder":[{"DOI":"10.13039\/501100003512","name":"State Administration of Foreign Experts Affairs","doi-asserted-by":"publisher","award":["111-2-07"],"award-info":[{"award-number":["111-2-07"]}],"id":[{"id":"10.13039\/501100003512","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100002338","name":"Ministry of Education of the People's Republic of China","doi-asserted-by":"publisher","award":["111-2-07"],"award-info":[{"award-number":["111-2-07"]}],"id":[{"id":"10.13039\/501100002338","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100004608","name":"Natural Science Foundation of Jiangsu Province","doi-asserted-by":"publisher","award":["BK20202009"],"award-info":[{"award-number":["BK20202009"]}],"id":[{"id":"10.13039\/501100004608","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100002949","name":"Government of Jiangsu Province","doi-asserted-by":"publisher","award":["BE2018710"],"award-info":[{"award-number":["BE2018710"]}],"id":[{"id":"10.13039\/501100002949","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100001809","name":"National Natural Science Foundation of China","doi-asserted-by":"publisher","award":["21971256"],"award-info":[{"award-number":["21971256"]}],"id":[{"id":"10.13039\/501100001809","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100001809","name":"National Natural Science Foundation of China","doi-asserted-by":"publisher","award":["21977118"],"award-info":[{"award-number":["21977118"]}],"id":[{"id":"10.13039\/501100001809","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100001809","name":"National Natural Science Foundation of China","doi-asserted-by":"publisher","award":["81730094"],"award-info":[{"award-number":["81730094"]}],"id":[{"id":"10.13039\/501100001809","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100001809","name":"National Natural Science Foundation of China","doi-asserted-by":"publisher","award":["81773584"],"award-info":[{"award-number":["81773584"]}],"id":[{"id":"10.13039\/501100001809","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100001809","name":"National Natural Science Foundation of China","doi-asserted-by":"publisher","award":["82073707"],"award-info":[{"award-number":["82073707"]}],"id":[{"id":"10.13039\/501100001809","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100001809","name":"National Natural Science Foundation of China","doi-asserted-by":"publisher","award":["91853125"],"award-info":[{"award-number":["91853125"]}],"id":[{"id":"10.13039\/501100001809","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Chem. Inf. Model."],"published-print":{"date-parts":[[2021,10,25]]},"DOI":"10.1021\/acs.jcim.1c00521","type":"journal-article","created":{"date-parts":[[2021,9,23]],"date-time":"2021-09-23T13:46:39Z","timestamp":1632404799000},"page":"5269-5279","source":"Crossref","is-referenced-by-count":25,"title":["Discovery of Novel Small Molecule Inhibitors Disrupting the PCSK9-LDLR Interaction"],"prefix":"10.1021","volume":"61","author":[{"given":"Hengzhi","family":"Sun","sequence":"first","affiliation":[{"name":"Jiangsu Key Laboratory of Drug Discovery for Metabolic Disease and State Key Laboratory of Natural Medicines, China Pharmaceutical University, Nanjing 210009, P. R. China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Jinzheng","family":"Wang","sequence":"additional","affiliation":[{"name":"Jiangsu Key Laboratory of Drug Discovery for Metabolic Disease and State Key Laboratory of Natural Medicines, China Pharmaceutical University, Nanjing 210009, P. R. China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Shengjie","family":"Liu","sequence":"additional","affiliation":[{"name":"Jiangsu Key Laboratory of Drug Discovery for Metabolic Disease and State Key Laboratory of Natural Medicines, China Pharmaceutical University, Nanjing 210009, P. R. China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Xinyu","family":"Zhou","sequence":"additional","affiliation":[{"name":"Jiangsu Key Laboratory of Drug Discovery for Metabolic Disease and State Key Laboratory of Natural Medicines, China Pharmaceutical University, Nanjing 210009, P. R. China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-0172-4759","authenticated-orcid":true,"given":"Liang","family":"Dai","sequence":"additional","affiliation":[{"name":"Jiangsu Key Laboratory of Drug Discovery for Metabolic Disease and State Key Laboratory of Natural Medicines, China Pharmaceutical University, Nanjing 210009, P. R. China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Caiping","family":"Chen","sequence":"additional","affiliation":[{"name":"Jiangsu Key Laboratory of Drug Discovery for Metabolic Disease and State Key Laboratory of Natural Medicines, China Pharmaceutical University, Nanjing 210009, P. R. China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-4450-6866","authenticated-orcid":true,"given":"Qinglong","family":"Xu","sequence":"additional","affiliation":[{"name":"Jiangsu Key Laboratory of Drug Discovery for Metabolic Disease and State Key Laboratory of Natural Medicines, China Pharmaceutical University, Nanjing 210009, P. R. China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-7852-1154","authenticated-orcid":true,"given":"Xiaoan","family":"Wen","sequence":"additional","affiliation":[{"name":"Jiangsu Key Laboratory of Drug Discovery for Metabolic Disease and State Key Laboratory of Natural Medicines, China Pharmaceutical University, Nanjing 210009, P. R. China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-2883-0845","authenticated-orcid":true,"given":"Keguang","family":"Cheng","sequence":"additional","affiliation":[{"name":"State Key Laboratory for Chemistry and Molecular Engineering of Medicinal Resources, School of Chemistry and Pharmacy, Guangxi Normal University, 15 Yucai Road, Guilin 541004, P. R. China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-3452-7674","authenticated-orcid":true,"given":"Hongbin","family":"Sun","sequence":"additional","affiliation":[{"name":"Jiangsu Key Laboratory of Drug Discovery for Metabolic Disease and State Key Laboratory of Natural Medicines, China Pharmaceutical University, Nanjing 210009, P. R. China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-0248-4347","authenticated-orcid":true,"given":"Haoliang","family":"Yuan","sequence":"additional","affiliation":[{"name":"Jiangsu Key Laboratory of Drug Discovery for Metabolic Disease and State Key Laboratory of Natural Medicines, China Pharmaceutical University, Nanjing 210009, P. R. China"}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"316","published-online":{"date-parts":[[2021,9,23]]},"reference":[{"key":"ref1\/cit1","doi-asserted-by":"publisher","DOI":"10.1016\/0092-8674(83)90052-1"},{"key":"ref2\/cit2","doi-asserted-by":"publisher","DOI":"10.1126\/science.3513311"},{"key":"ref3\/cit3","doi-asserted-by":"publisher","DOI":"10.1016\/j.abb.2003.09.011"},{"key":"ref4\/cit4","doi-asserted-by":"publisher","DOI":"10.2174\/0929867324666170303123734"},{"key":"ref5\/cit5","doi-asserted-by":"publisher","DOI":"10.1111\/j.1600-0854.2007.00562.x"},{"key":"ref6\/cit6","doi-asserted-by":"publisher","DOI":"10.1074\/jbc.C700095200"},{"key":"ref7\/cit7","doi-asserted-by":"publisher","DOI":"10.1073\/pnas.0335507100"},{"key":"ref8\/cit8","doi-asserted-by":"publisher","DOI":"10.1038\/nsmb1235"},{"key":"ref9\/cit9","doi-asserted-by":"publisher","DOI":"10.1194\/jlr.R800091-JLR200"},{"key":"ref10\/cit10","doi-asserted-by":"publisher","DOI":"10.1194\/jlr.M700071-JLR200"},{"key":"ref11\/cit11","doi-asserted-by":"publisher","DOI":"10.1056\/NEJMoa1501031"},{"key":"ref12\/cit12","doi-asserted-by":"publisher","DOI":"10.1056\/NEJMoa1500858"},{"key":"ref13\/cit13","doi-asserted-by":"publisher","DOI":"10.1016\/S0140-6736(19)31950-6"},{"key":"ref14\/cit14","doi-asserted-by":"publisher","DOI":"10.1056\/NEJMoa1615664"},{"key":"ref15\/cit15","doi-asserted-by":"publisher","DOI":"10.1056\/NEJMoa1801174"},{"key":"ref16\/cit16","doi-asserted-by":"publisher","DOI":"10.3389\/fphar.2017.00881"},{"key":"ref17\/cit17","doi-asserted-by":"publisher","DOI":"10.1016\/S0163-7258(00)00052-8"},{"key":"ref18\/cit18","doi-asserted-by":"publisher","DOI":"10.2174\/1389450116666150223115628"},{"key":"ref19\/cit19","doi-asserted-by":"publisher","DOI":"10.1038\/nrc3690"},{"key":"ref20\/cit20","doi-asserted-by":"publisher","DOI":"10.1038\/nrd1343"},{"key":"ref21\/cit21","doi-asserted-by":"publisher","DOI":"10.1016\/j.cbpa.2009.05.125"},{"key":"ref22\/cit22","doi-asserted-by":"publisher","DOI":"10.1017\/S0033583512000108"},{"key":"ref23\/cit23","doi-asserted-by":"publisher","DOI":"10.1017\/erm.2012.10"},{"key":"ref24\/cit24","doi-asserted-by":"publisher","DOI":"10.1002\/iub.383"},{"key":"ref25\/cit25","doi-asserted-by":"publisher","DOI":"10.1038\/nature06526"},{"key":"ref26\/cit26","doi-asserted-by":"publisher","DOI":"10.1021\/cr400698c"},{"key":"ref27\/cit27","unstructured":"Chupak, L. S.; Zheng, X. Preparation of compounds useful as immunomodulators. World Patent WO15034820A1, 2015."},{"key":"ref28\/cit28","doi-asserted-by":"publisher","DOI":"10.1021\/ja970702x"},{"key":"ref29\/cit29","doi-asserted-by":"publisher","DOI":"10.1021\/jm051122a"},{"key":"ref30\/cit30","doi-asserted-by":"publisher","DOI":"10.1126\/science.1092472"},{"key":"ref31\/cit31","doi-asserted-by":"publisher","DOI":"10.1038\/s41568-019-0196-7"},{"key":"ref32\/cit32","doi-asserted-by":"publisher","DOI":"10.1038\/nm.3048"},{"key":"ref33\/cit33","doi-asserted-by":"publisher","DOI":"10.1182\/blood-2007-12-130781"},{"key":"ref34\/cit34","doi-asserted-by":"publisher","DOI":"10.1073\/pnas.0712064105"},{"key":"ref35\/cit35","doi-asserted-by":"publisher","DOI":"10.1074\/jbc.M808363200"},{"key":"ref36\/cit36","doi-asserted-by":"publisher","DOI":"10.1038\/embor.2011.205"},{"key":"ref37\/cit37","doi-asserted-by":"publisher","DOI":"10.1074\/jbc.M113.514067"},{"key":"ref38\/cit38","doi-asserted-by":"publisher","DOI":"10.3349\/ymj.2015.56.5.1251"},{"key":"ref39\/cit39","doi-asserted-by":"publisher","DOI":"10.1021\/jacs.7b09360"},{"key":"ref40\/cit40","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jmedchem.9b00402"},{"key":"ref41\/cit41","doi-asserted-by":"publisher","DOI":"10.1016\/j.bmc.2020.115344"},{"key":"ref42\/cit42","doi-asserted-by":"publisher","DOI":"10.1073\/pnas.0806312105"},{"key":"ref43\/cit43","doi-asserted-by":"publisher","DOI":"10.1074\/jbc.M114.594861"},{"key":"ref44\/cit44","unstructured":"Abdel-Meguid, S. S.; Elshourbagy, N.; Meyers, H.; Mousa, S. A. Anti-proprotein convertase subtilisin kexin type 9 (anti-PCSK9) compounds and methods of using the same in the treatment and\/or prevention of cardiovascular diseases. World Patent WO2014150326A1, 2014."},{"key":"ref45\/cit45","unstructured":"Abou-Gharbia, M.; Childers, W. E. PCSK9 inhibitors and methods of use thereof. World Patent WO2016040305A1, 2016."},{"key":"ref46\/cit46","doi-asserted-by":"publisher","DOI":"10.1016\/j.ymeth.2017.08.006"},{"key":"ref47\/cit47","doi-asserted-by":"publisher","DOI":"10.2174\/1568026619666190304152704"},{"key":"ref48\/cit48","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.0c00154"},{"key":"ref49\/cit49","doi-asserted-by":"publisher","DOI":"10.1016\/j.biomaterials.2007.01.047"},{"key":"ref50\/cit50","doi-asserted-by":"publisher","DOI":"10.1038\/nm1135"},{"key":"ref51\/cit51","doi-asserted-by":"publisher","DOI":"10.1016\/j.atherosclerosis.2008.02.004"}],"container-title":["Journal of Chemical Information and Modeling"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jcim.1c00521","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2023,4,26]],"date-time":"2023-04-26T19:55:46Z","timestamp":1682538946000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/acs.jcim.1c00521"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2021,9,23]]},"references-count":51,"journal-issue":{"issue":"10","published-print":{"date-parts":[[2021,10,25]]}},"alternative-id":["10.1021\/acs.jcim.1c00521"],"URL":"https:\/\/doi.org\/10.1021\/acs.jcim.1c00521","relation":{},"ISSN":["1549-9596","1549-960X"],"issn-type":[{"value":"1549-9596","type":"print"},{"value":"1549-960X","type":"electronic"}],"subject":[],"published":{"date-parts":[[2021,9,23]]}}}