{"id":"https://openalex.org/W2017078494","doi":"https://doi.org/10.1021/ci3004545","title":"Discovery of Novel Acetohydroxyacid Synthase Inhibitors as Active Agents against<i>Mycobacterium tuberculosis</i>by Virtual Screening and Bioassay","display_name":"Discovery of Novel Acetohydroxyacid Synthase Inhibitors as Active Agents against<i>Mycobacterium tuberculosis</i>by Virtual Screening and Bioassay","publication_year":2013,"publication_date":"2013-01-14","ids":{"openalex":"https://openalex.org/W2017078494","doi":"https://doi.org/10.1021/ci3004545","mag":"2017078494","pmid":"https://pubmed.ncbi.nlm.nih.gov/23316686"},"language":"en","primary_location":{"id":"doi:10.1021/ci3004545","is_oa":false,"landing_page_url":"https://doi.org/10.1021/ci3004545","pdf_url":null,"source":{"id":"https://openalex.org/S167262187","display_name":"Journal of Chemical Information and Modeling","issn_l":"1549-9596","issn":["1549-9596","1549-960X"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310320006","host_organization_name":"American Chemical Society","host_organization_lineage":["https://openalex.org/P4310320006"],"host_organization_lineage_names":["American Chemical Society"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Chemical Information and Modeling","raw_type":"journal-article"},"type":"article","indexed_in":["crossref","pubmed"],"open_access":{"is_oa":false,"oa_status":"closed","oa_url":null,"any_repository_has_fulltext":false},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5100401464","display_name":"Di Wang","orcid":"https://orcid.org/0000-0003-0870-2157"},"institutions":[{"id":"https://openalex.org/I4210096476","display_name":"307th Hospital of Chinese People\u2019s Liberation Army","ror":"https://ror.org/00vrd0936","country_code":"CN","type":"healthcare","lineage":["https://openalex.org/I4210096476"]},{"id":"https://openalex.org/I4210144506","display_name":"The 309th Hospital of Chinese People's Liberation Army","ror":"https://ror.org/046x15q93","country_code":"CN","type":"healthcare","lineage":["https://openalex.org/I4210144506"]},{"id":"https://openalex.org/I4210162172","display_name":"Chinese People\u2019s Liberation Army 263 hospital","ror":"https://ror.org/05b51ak88","country_code":"CN","type":"company","lineage":["https://openalex.org/I4210162172"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Di Wang","raw_affiliation_strings":["Department of Clinical Laboratory, 309 Hospital of Chinese People\u2019s Liberation Army, Beijing 100091, China","Department of Clinical Laboratory, 309 Hospital of Chinese People's Liberation Army, Beijing 100091, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Clinical Laboratory, 309 Hospital of Chinese People\u2019s Liberation Army, Beijing 100091, China","institution_ids":["https://openalex.org/I4210144506"]},{"raw_affiliation_string":"Department of Clinical Laboratory, 309 Hospital of Chinese People's Liberation Army, Beijing 100091, China","institution_ids":["https://openalex.org/I4210162172","https://openalex.org/I4210096476","https://openalex.org/I4210144506"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5101130426","display_name":"Xuelian Zhu","orcid":"https://orcid.org/0009-0009-1243-765X"},"institutions":[{"id":"https://openalex.org/I4210112820","display_name":"Shanghai Institute of Materia Medica","ror":"https://ror.org/022syn853","country_code":"CN","type":"facility","lineage":["https://openalex.org/I19820366","https://openalex.org/I4210112820"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Xuelian Zhu","raw_affiliation_strings":["State Key Laboratory of Drug Research, Drug Discovery and Design Center, Shanghai Institute of Materia Medica, Shanghai 201203, China","State Key Laboratory#R#of Drug#R#Research, Drug Discovery and Design Center, Shanghai Institute of#R#Materia Medica, Shanghai 201203, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"State Key Laboratory of Drug Research, Drug Discovery and Design Center, Shanghai Institute of Materia Medica, Shanghai 201203, China","institution_ids":["https://openalex.org/I4210112820"]},{"raw_affiliation_string":"State Key Laboratory#R#of Drug#R#Research, Drug Discovery and Design Center, Shanghai Institute of#R#Materia Medica, Shanghai 201203, China","institution_ids":["https://openalex.org/I4210112820"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5102667572","display_name":"Changjun Cui","orcid":null},"institutions":[{"id":"https://openalex.org/I205237279","display_name":"Nankai University","ror":"https://ror.org/01y1kjr75","country_code":"CN","type":"education","lineage":["https://openalex.org/I205237279"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Changjun Cui","raw_affiliation_strings":["State Key Laboratory and Institute of Elemento-Organic Chemistry, Nankai University, Tianjin 300071, China","State-Key Laboratory and Institute#R#of Elemento-Organic Chemistry, Nankai University, Tianjin 300071, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"State Key Laboratory and Institute of Elemento-Organic Chemistry, Nankai University, Tianjin 300071, China","institution_ids":["https://openalex.org/I205237279"]},{"raw_affiliation_string":"State-Key Laboratory and Institute#R#of Elemento-Organic Chemistry, Nankai University, Tianjin 300071, China","institution_ids":["https://openalex.org/I205237279"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5100959069","display_name":"Mei Dong","orcid":"https://orcid.org/0000-0002-5209-2627"},"institutions":[{"id":"https://openalex.org/I4210096476","display_name":"307th Hospital of Chinese People\u2019s Liberation Army","ror":"https://ror.org/00vrd0936","country_code":"CN","type":"healthcare","lineage":["https://openalex.org/I4210096476"]},{"id":"https://openalex.org/I4210144506","display_name":"The 309th Hospital of Chinese People's Liberation Army","ror":"https://ror.org/046x15q93","country_code":"CN","type":"healthcare","lineage":["https://openalex.org/I4210144506"]},{"id":"https://openalex.org/I4210162172","display_name":"Chinese People\u2019s Liberation Army 263 hospital","ror":"https://ror.org/05b51ak88","country_code":"CN","type":"company","lineage":["https://openalex.org/I4210162172"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Mei Dong","raw_affiliation_strings":["Department of Clinical Laboratory, 309 Hospital of Chinese People\u2019s Liberation Army, Beijing 100091, China","Department of Clinical Laboratory, 309 Hospital of Chinese People's Liberation Army, Beijing 100091, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Clinical Laboratory, 309 Hospital of Chinese People\u2019s Liberation Army, Beijing 100091, China","institution_ids":["https://openalex.org/I4210144506"]},{"raw_affiliation_string":"Department of Clinical Laboratory, 309 Hospital of Chinese People's Liberation Army, Beijing 100091, China","institution_ids":["https://openalex.org/I4210162172","https://openalex.org/I4210096476","https://openalex.org/I4210144506"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5001392142","display_name":"Hualiang Jiang","orcid":"https://orcid.org/0000-0003-0656-6315"},"institutions":[{"id":"https://openalex.org/I4210112820","display_name":"Shanghai Institute of Materia Medica","ror":"https://ror.org/022syn853","country_code":"CN","type":"facility","lineage":["https://openalex.org/I19820366","https://openalex.org/I4210112820"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Hualiang Jiang","raw_affiliation_strings":["State Key Laboratory of Drug Research, Drug Discovery and Design Center, Shanghai Institute of Materia Medica, Shanghai 201203, China","State Key Laboratory#R#of Drug#R#Research, Drug Discovery and Design Center, Shanghai Institute of#R#Materia Medica, Shanghai 201203, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"State Key Laboratory of Drug Research, Drug Discovery and Design Center, Shanghai Institute of Materia Medica, Shanghai 201203, China","institution_ids":["https://openalex.org/I4210112820"]},{"raw_affiliation_string":"State Key Laboratory#R#of Drug#R#Research, Drug Discovery and Design Center, Shanghai Institute of#R#Materia Medica, Shanghai 201203, China","institution_ids":["https://openalex.org/I4210112820"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5101965250","display_name":"Zhengming Li","orcid":"https://orcid.org/0000-0002-0608-7819"},"institutions":[{"id":"https://openalex.org/I205237279","display_name":"Nankai University","ror":"https://ror.org/01y1kjr75","country_code":"CN","type":"education","lineage":["https://openalex.org/I205237279"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Zhengming Li","raw_affiliation_strings":["State Key Laboratory and Institute of Elemento-Organic Chemistry, Nankai University, Tianjin 300071, China","State-Key Laboratory and Institute#R#of Elemento-Organic Chemistry, Nankai University, Tianjin 300071, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"State Key Laboratory and Institute of Elemento-Organic Chemistry, Nankai University, Tianjin 300071, China","institution_ids":["https://openalex.org/I205237279"]},{"raw_affiliation_string":"State-Key Laboratory and Institute#R#of Elemento-Organic Chemistry, Nankai University, Tianjin 300071, China","institution_ids":["https://openalex.org/I205237279"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5065301127","display_name":"Zhen Liu","orcid":"https://orcid.org/0000-0002-1119-0693"},"institutions":[{"id":"https://openalex.org/I4210096476","display_name":"307th Hospital of Chinese People\u2019s Liberation Army","ror":"https://ror.org/00vrd0936","country_code":"CN","type":"healthcare","lineage":["https://openalex.org/I4210096476"]},{"id":"https://openalex.org/I4210144506","display_name":"The 309th Hospital of Chinese People's Liberation Army","ror":"https://ror.org/046x15q93","country_code":"CN","type":"healthcare","lineage":["https://openalex.org/I4210144506"]},{"id":"https://openalex.org/I4210162172","display_name":"Chinese People\u2019s Liberation Army 263 hospital","ror":"https://ror.org/05b51ak88","country_code":"CN","type":"company","lineage":["https://openalex.org/I4210162172"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Zhen Liu","raw_affiliation_strings":["Department of Clinical Laboratory, 309 Hospital of Chinese People\u2019s Liberation Army, Beijing 100091, China","Department of Clinical Laboratory, 309 Hospital of Chinese People's Liberation Army, Beijing 100091, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Clinical Laboratory, 309 Hospital of Chinese People\u2019s Liberation Army, Beijing 100091, China","institution_ids":["https://openalex.org/I4210144506"]},{"raw_affiliation_string":"Department of Clinical Laboratory, 309 Hospital of Chinese People's Liberation Army, Beijing 100091, China","institution_ids":["https://openalex.org/I4210162172","https://openalex.org/I4210096476","https://openalex.org/I4210144506"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5059083216","display_name":"Weiliang Zhu","orcid":"https://orcid.org/0000-0001-6699-5299"},"institutions":[{"id":"https://openalex.org/I4210112820","display_name":"Shanghai Institute of Materia Medica","ror":"https://ror.org/022syn853","country_code":"CN","type":"facility","lineage":["https://openalex.org/I19820366","https://openalex.org/I4210112820"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Weiliang Zhu","raw_affiliation_strings":["State Key Laboratory of Drug Research, Drug Discovery and Design Center, Shanghai Institute of Materia Medica, Shanghai 201203, China","State Key Laboratory#R#of Drug#R#Research, Drug Discovery and Design Center, Shanghai Institute of#R#Materia Medica, Shanghai 201203, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"State Key Laboratory of Drug Research, Drug Discovery and Design Center, Shanghai Institute of Materia Medica, Shanghai 201203, China","institution_ids":["https://openalex.org/I4210112820"]},{"raw_affiliation_string":"State Key Laboratory#R#of Drug#R#Research, Drug Discovery and Design Center, Shanghai Institute of#R#Materia Medica, Shanghai 201203, China","institution_ids":["https://openalex.org/I4210112820"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5100336329","display_name":"Jian\u2010Guo Wang","orcid":"https://orcid.org/0000-0001-7577-1502"},"institutions":[{"id":"https://openalex.org/I205237279","display_name":"Nankai University","ror":"https://ror.org/01y1kjr75","country_code":"CN","type":"education","lineage":["https://openalex.org/I205237279"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Jian-Guo Wang","raw_affiliation_strings":["State Key Laboratory and Institute of Elemento-Organic Chemistry, Nankai University, Tianjin 300071, China","State-Key Laboratory and Institute#R#of Elemento-Organic Chemistry, Nankai University, Tianjin 300071, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"State Key Laboratory and Institute of Elemento-Organic Chemistry, Nankai University, Tianjin 300071, China","institution_ids":["https://openalex.org/I205237279"]},{"raw_affiliation_string":"State-Key Laboratory and Institute#R#of Elemento-Organic Chemistry, Nankai University, Tianjin 300071, China","institution_ids":["https://openalex.org/I205237279"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":9,"corresponding_author_ids":[],"corresponding_institution_ids":[],"apc_list":null,"apc_paid":null,"fwci":2.8024,"has_fulltext":false,"cited_by_count":43,"citation_normalized_percentile":{"value":0.90440858,"is_in_top_1_percent":false,"is_in_top_10_percent":true},"cited_by_percentile_year":{"min":89,"max":99},"biblio":{"volume":"53","issue":"2","first_page":"343","last_page":"353"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10038","display_name":"Tuberculosis Research and Epidemiology","score":0.9998000264167786,"subfield":{"id":"https://openalex.org/subfields/2725","display_name":"Infectious Diseases"},"field":{"id":"https://openalex.org/fields/27","display_name":"Medicine"},"domain":{"id":"https://openalex.org/domains/4","display_name":"Health Sciences"}},"topics":[{"id":"https://openalex.org/T10038","display_name":"Tuberculosis Research and Epidemiology","score":0.9998000264167786,"subfield":{"id":"https://openalex.org/subfields/2725","display_name":"Infectious Diseases"},"field":{"id":"https://openalex.org/fields/27","display_name":"Medicine"},"domain":{"id":"https://openalex.org/domains/4","display_name":"Health Sciences"}},{"id":"https://openalex.org/T12827","display_name":"Biochemical and Molecular Research","score":0.9966999888420105,"subfield":{"id":"https://openalex.org/subfields/1312","display_name":"Molecular Biology"},"field":{"id":"https://openalex.org/fields/13","display_name":"Biochemistry, Genetics and Molecular Biology"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}},{"id":"https://openalex.org/T10274","display_name":"Synthesis and biological activity","score":0.9872000217437744,"subfield":{"id":"https://openalex.org/subfields/1605","display_name":"Organic Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/bioassay","display_name":"Bioassay","score":0.8307121992111206},{"id":"https://openalex.org/keywords/virtual-screening","display_name":"Virtual screening","score":0.8035429120063782},{"id":"https://openalex.org/keywords/mycobacterium-tuberculosis","display_name":"Mycobacterium tuberculosis","score":0.771733283996582},{"id":"https://openalex.org/keywords/drug-discovery","display_name":"Drug discovery","score":0.5725465416908264},{"id":"https://openalex.org/keywords/chemistry","display_name":"Chemistry","score":0.5114123225212097},{"id":"https://openalex.org/keywords/tuberculosis","display_name":"Tuberculosis","score":0.4856330454349518},{"id":"https://openalex.org/keywords/computational-biology","display_name":"Computational biology","score":0.3964793086051941},{"id":"https://openalex.org/keywords/microbiology","display_name":"Microbiology","score":0.3907196521759033},{"id":"https://openalex.org/keywords/pharmacology","display_name":"Pharmacology","score":0.34033405780792236},{"id":"https://openalex.org/keywords/biochemistry","display_name":"Biochemistry","score":0.3301779627799988},{"id":"https://openalex.org/keywords/virology","display_name":"Virology","score":0.32294225692749023},{"id":"https://openalex.org/keywords/biology","display_name":"Biology","score":0.30076465010643005},{"id":"https://openalex.org/keywords/medicine","display_name":"Medicine","score":0.2640739679336548},{"id":"https://openalex.org/keywords/pathology","display_name":"Pathology","score":0.08908352255821228},{"id":"https://openalex.org/keywords/genetics","display_name":"Genetics","score":0.08471733331680298}],"concepts":[{"id":"https://openalex.org/C104488531","wikidata":"https://www.wikidata.org/wiki/Q864212","display_name":"Bioassay","level":2,"score":0.8307121992111206},{"id":"https://openalex.org/C103697762","wikidata":"https://www.wikidata.org/wiki/Q4112105","display_name":"Virtual screening","level":3,"score":0.8035429120063782},{"id":"https://openalex.org/C2777975735","wikidata":"https://www.wikidata.org/wiki/Q130971","display_name":"Mycobacterium tuberculosis","level":3,"score":0.771733283996582},{"id":"https://openalex.org/C74187038","wikidata":"https://www.wikidata.org/wiki/Q1418791","display_name":"Drug discovery","level":2,"score":0.5725465416908264},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.5114123225212097},{"id":"https://openalex.org/C2781069245","wikidata":"https://www.wikidata.org/wiki/Q12204","display_name":"Tuberculosis","level":2,"score":0.4856330454349518},{"id":"https://openalex.org/C70721500","wikidata":"https://www.wikidata.org/wiki/Q177005","display_name":"Computational biology","level":1,"score":0.3964793086051941},{"id":"https://openalex.org/C89423630","wikidata":"https://www.wikidata.org/wiki/Q7193","display_name":"Microbiology","level":1,"score":0.3907196521759033},{"id":"https://openalex.org/C98274493","wikidata":"https://www.wikidata.org/wiki/Q128406","display_name":"Pharmacology","level":1,"score":0.34033405780792236},{"id":"https://openalex.org/C55493867","wikidata":"https://www.wikidata.org/wiki/Q7094","display_name":"Biochemistry","level":1,"score":0.3301779627799988},{"id":"https://openalex.org/C159047783","wikidata":"https://www.wikidata.org/wiki/Q7215","display_name":"Virology","level":1,"score":0.32294225692749023},{"id":"https://openalex.org/C86803240","wikidata":"https://www.wikidata.org/wiki/Q420","display_name":"Biology","level":0,"score":0.30076465010643005},{"id":"https://openalex.org/C71924100","wikidata":"https://www.wikidata.org/wiki/Q11190","display_name":"Medicine","level":0,"score":0.2640739679336548},{"id":"https://openalex.org/C142724271","wikidata":"https://www.wikidata.org/wiki/Q7208","display_name":"Pathology","level":1,"score":0.08908352255821228},{"id":"https://openalex.org/C54355233","wikidata":"https://www.wikidata.org/wiki/Q7162","display_name":"Genetics","level":1,"score":0.08471733331680298}],"mesh":[{"descriptor_ui":"D000095","descriptor_name":"Acetolactate Synthase","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D000095","descriptor_name":"Acetolactate Synthase","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D000095","descriptor_name":"Acetolactate Synthase","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D000095","descriptor_name":"Acetolactate Synthase","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D000095","descriptor_name":"Acetolactate Synthase","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D000095","descriptor_name":"Acetolactate Synthase","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D000995","descriptor_name":"Antitubercular Agents","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":false},{"descriptor_ui":"D000995","descriptor_name":"Antitubercular Agents","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":false},{"descriptor_ui":"D000995","descriptor_name":"Antitubercular Agents","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":false},{"descriptor_ui":"D000995","descriptor_name":"Antitubercular Agents","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D000995","descriptor_name":"Antitubercular Agents","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D000995","descriptor_name":"Antitubercular Agents","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D002460","descriptor_name":"Cell Line","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D002460","descriptor_name":"Cell Line","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D002460","descriptor_name":"Cell Line","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D006801","descriptor_name":"Humans","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D006801","descriptor_name":"Humans","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D006801","descriptor_name":"Humans","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008264","descriptor_name":"Macrophages","qualifier_ui":"Q000382","qualifier_name":"microbiology","is_major_topic":false},{"descriptor_ui":"D008264","descriptor_name":"Macrophages","qualifier_ui":"Q000382","qualifier_name":"microbiology","is_major_topic":false},{"descriptor_ui":"D008264","descriptor_name":"Macrophages","qualifier_ui":"Q000382","qualifier_name":"microbiology","is_major_topic":false},{"descriptor_ui":"D008826","descriptor_name":"Microbial Sensitivity Tests","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008826","descriptor_name":"Microbial Sensitivity Tests","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008826","descriptor_name":"Microbial Sensitivity Tests","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D009169","descriptor_name":"Mycobacterium tuberculosis","qualifier_ui":"Q000187","qualifier_name":"drug effects","is_major_topic":false},{"descriptor_ui":"D009169","descriptor_name":"Mycobacterium tuberculosis","qualifier_ui":"Q000187","qualifier_name":"drug effects","is_major_topic":false},{"descriptor_ui":"D009169","descriptor_name":"Mycobacterium tuberculosis","qualifier_ui":"Q000187","qualifier_name":"drug effects","is_major_topic":false},{"descriptor_ui":"D009169","descriptor_name":"Mycobacterium tuberculosis","qualifier_ui":"Q000201","qualifier_name":"enzymology","is_major_topic":false},{"descriptor_ui":"D009169","descriptor_name":"Mycobacterium tuberculosis","qualifier_ui":"Q000201","qualifier_name":"enzymology","is_major_topic":false},{"descriptor_ui":"D009169","descriptor_name":"Mycobacterium tuberculosis","qualifier_ui":"Q000201","qualifier_name":"enzymology","is_major_topic":false},{"descriptor_ui":"D014376","descriptor_name":"Tuberculosis","qualifier_ui":"Q000188","qualifier_name":"drug therapy","is_major_topic":false},{"descriptor_ui":"D014376","descriptor_name":"Tuberculosis","qualifier_ui":"Q000188","qualifier_name":"drug therapy","is_major_topic":false},{"descriptor_ui":"D014376","descriptor_name":"Tuberculosis","qualifier_ui":"Q000188","qualifier_name":"drug therapy","is_major_topic":false},{"descriptor_ui":"D014376","descriptor_name":"Tuberculosis","qualifier_ui":"Q000382","qualifier_name":"microbiology","is_major_topic":false},{"descriptor_ui":"D014376","descriptor_name":"Tuberculosis","qualifier_ui":"Q000382","qualifier_name":"microbiology","is_major_topic":false},{"descriptor_ui":"D014376","descriptor_name":"Tuberculosis","qualifier_ui":"Q000382","qualifier_name":"microbiology","is_major_topic":false},{"descriptor_ui":"D062105","descriptor_name":"Molecular Docking Simulation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D062105","descriptor_name":"Molecular Docking Simulation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D062105","descriptor_name":"Molecular Docking Simulation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false}],"locations_count":2,"locations":[{"id":"doi:10.1021/ci3004545","is_oa":false,"landing_page_url":"https://doi.org/10.1021/ci3004545","pdf_url":null,"source":{"id":"https://openalex.org/S167262187","display_name":"Journal of Chemical Information and Modeling","issn_l":"1549-9596","issn":["1549-9596","1549-960X"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310320006","host_organization_name":"American Chemical Society","host_organization_lineage":["https://openalex.org/P4310320006"],"host_organization_lineage_names":["American Chemical Society"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Chemical Information and Modeling","raw_type":"journal-article"},{"id":"pmid:23316686","is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/23316686","pdf_url":null,"source":{"id":"https://openalex.org/S4306525036","display_name":"PubMed","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I1299303238","host_organization_name":"National Institutes of Health","host_organization_lineage":["https://openalex.org/I1299303238"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of chemical information and modeling","raw_type":null}],"best_oa_location":null,"sustainable_development_goals":[{"display_name":"Good health and well-being","score":0.8199999928474426,"id":"https://metadata.un.org/sdg/3"}],"awards":[],"funders":[],"has_content":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":35,"referenced_works":["https://openalex.org/W1622528294","https://openalex.org/W1971785714","https://openalex.org/W1975121238","https://openalex.org/W1980052054","https://openalex.org/W1986106712","https://openalex.org/W1986191025","https://openalex.org/W1989419188","https://openalex.org/W1992192767","https://openalex.org/W2005610896","https://openalex.org/W2015212841","https://openalex.org/W2018430005","https://openalex.org/W2018468640","https://openalex.org/W2020189903","https://openalex.org/W2045483281","https://openalex.org/W2060600925","https://openalex.org/W2062291020","https://openalex.org/W2069291992","https://openalex.org/W2072292761","https://openalex.org/W2081912151","https://openalex.org/W2085410258","https://openalex.org/W2098875642","https://openalex.org/W2103428939","https://openalex.org/W2106882534","https://openalex.org/W2108107014","https://openalex.org/W2120010485","https://openalex.org/W2121553633","https://openalex.org/W2122199548","https://openalex.org/W2127760066","https://openalex.org/W2136665220","https://openalex.org/W2148968042","https://openalex.org/W2162691848","https://openalex.org/W2166077367","https://openalex.org/W2170306976","https://openalex.org/W2186101301","https://openalex.org/W2342885121"],"related_works":["https://openalex.org/W2059230675","https://openalex.org/W4308058527","https://openalex.org/W2972094210","https://openalex.org/W2110949356","https://openalex.org/W2376003823","https://openalex.org/W1538374398","https://openalex.org/W2050407936","https://openalex.org/W2042252940","https://openalex.org/W2411061500","https://openalex.org/W3160640465"],"abstract_inverted_index":{"Acetohydroxyacid":[0],"synthase":[1],"(AHAS)":[2],"has":[3],"been":[4],"regarded":[5],"as":[6,15,111],"a":[7],"promising":[8],"drug":[9],"target":[10],"against":[11,53,66,96],"Mycobacterium":[12],"tuberculosis":[13],"(MTB)":[14],"it":[16],"catalyzes":[17],"the":[18,58,71,93],"biosynthesis":[19],"of":[20,57,73],"branched-chain":[21],"amino":[22],"acids.":[23],"In":[24],"this":[25],"study,":[26],"23":[27],"novel":[28,112],"AHAS":[29],"inhibitors":[30,106],"were":[31],"identified":[32,59],"through":[33],"molecular":[34],"docking":[35],"followed":[36],"by":[37],"similarity":[38],"search.":[39],"The":[40],"determined":[41],"IC(50)":[42],"values":[43],"range":[44,72],"from":[45],"0.385":[46],"\u00b1":[47],"0.026":[48],"\u03bcM":[49,52],"to":[50],">200":[51],"bacterium":[54],"AHAS.":[55,116],"Five":[56],"compounds":[60,87],"show":[61],"significant":[62],"in":[63,70],"vitro":[64],"activity":[65],"H37Rv":[67],"strains":[68],"(MICs":[69],"2.5-80":[74],"mg/L)":[75],"and":[76,82,89],"clinical":[77],"MTB":[78],"strains,":[79],"including":[80],"MDR":[81],"XDR":[83],"isolates.":[84],"More":[85],"impressively,":[86],"5":[88],"7":[90],"can":[91,107],"enhance":[92],"killing":[94],"ability":[95],"macrophages":[97],"infected":[98],"pathogen":[99],"remarkably.":[100],"This":[101],"study":[102],"suggests":[103],"our":[104],"discovered":[105],"be":[108],"further":[109],"developed":[110],"anti-MTB":[113],"therapeutics":[114],"targeting":[115]},"counts_by_year":[{"year":2025,"cited_by_count":1},{"year":2024,"cited_by_count":2},{"year":2023,"cited_by_count":3},{"year":2022,"cited_by_count":4},{"year":2021,"cited_by_count":1},{"year":2020,"cited_by_count":3},{"year":2019,"cited_by_count":6},{"year":2018,"cited_by_count":3},{"year":2017,"cited_by_count":4},{"year":2016,"cited_by_count":5},{"year":2015,"cited_by_count":4},{"year":2014,"cited_by_count":6},{"year":2013,"cited_by_count":1}],"updated_date":"2026-06-11T09:08:48.828518","created_date":"2016-06-24T00:00:00"}