{"id":"https://openalex.org/W2153449339","doi":"https://doi.org/10.2174/156802610791111498","title":"G Protein Coupled Receptors - In Silico Drug Discovery and Design","display_name":"G Protein Coupled Receptors - In Silico Drug Discovery and Design","publication_year":2010,"publication_date":"2010-04-01","ids":{"openalex":"https://openalex.org/W2153449339","doi":"https://doi.org/10.2174/156802610791111498","mag":"2153449339","pmid":"https://pubmed.ncbi.nlm.nih.gov/20337589"},"language":"en","primary_location":{"id":"doi:10.2174/156802610791111498","doi":"https://doi.org/10.2174/156802610791111498","is_oa":false,"landing_page_url":"https://doi.org/10.2174/156802610791111498","pdf_url":null,"source":{"id":"https://openalex.org/S107732428","display_name":"Current Topics in Medicinal Chemistry","issn_l":"1568-0266","issn":["1568-0266","1873-4294"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","jufo-1","ki-jl-1","medline","norway-1","poland-100","russia-white-list-1"],"host_organization":"https://openalex.org/P4310320079","host_organization_name":"Bentham Science Publishers","host_organization_lineage":["https://openalex.org/P4310320079"],"host_organization_lineage_names":["Bentham Science Publishers"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Current Topics in Medicinal Chemistry","raw_type":"journal-article"},"volume":null,"type":"article","is_traditional":true,"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/A5089719407","display_name":"Itamar Sela","orcid":"https://orcid.org/0000-0003-0270-6392","observed_orcids":["https://orcid.org/0000-0003-0270-6392"]},"institutions":[],"countries":[],"is_corresponding":true,"raw_author_name":"I. Sela","raw_affiliation_strings":["EPIX Pharmaceuticals Ltd., Ramat Gan 52521, Israel","8 Eybeschuts st. Tel-Aviv 62741, Israel.,Israel"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"EPIX Pharmaceuticals Ltd., Ramat Gan 52521, Israel","institution_ids":[]},{"raw_affiliation_string":"8 Eybeschuts st. Tel-Aviv 62741, Israel.,Israel","institution_ids":[]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5052383848","display_name":"Gali Golan","orcid":null,"observed_orcids":[]},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"G. Golan","raw_affiliation_strings":[],"raw_orcid":null,"affiliations":[]},{"author_position":"middle","author":{"id":"https://openalex.org/A5073286506","display_name":"M. Strajbl","orcid":null,"observed_orcids":[]},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"M. Strajbl","raw_affiliation_strings":[],"raw_orcid":null,"affiliations":[]},{"author_position":"middle","author":{"id":"https://openalex.org/A5004169578","display_name":"Dalia Rivenzon\u2010Segal","orcid":null,"observed_orcids":[]},"institutions":[],"countries":[],"is_corresponding":true,"raw_author_name":"D. Rivenzon-Segal","raw_affiliation_strings":["8 Eybeschuts st. Tel-Aviv 62741, Israel.,Israel"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"8 Eybeschuts st. Tel-Aviv 62741, Israel.,Israel","institution_ids":[]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5072713664","display_name":"Shay Bar\u2010Haim","orcid":null,"observed_orcids":[]},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"S. Bar-Haim","raw_affiliation_strings":[],"raw_orcid":null,"affiliations":[]},{"author_position":"middle","author":{"id":"https://openalex.org/A5004761084","display_name":"Idit Bloch","orcid":"https://orcid.org/0000-0001-9669-8367","observed_orcids":["https://orcid.org/0000-0001-9669-8367"]},"institutions":[],"countries":[],"is_corresponding":true,"raw_author_name":"I. Bloch","raw_affiliation_strings":["8 Eybeschuts st. Tel-Aviv 62741, Israel.,Israel"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"8 Eybeschuts st. Tel-Aviv 62741, Israel.,Israel","institution_ids":[]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5031736156","display_name":"Boaz Inbal","orcid":null,"observed_orcids":[]},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"B. Inbal","raw_affiliation_strings":[],"raw_orcid":null,"affiliations":[]},{"author_position":"middle","author":{"id":"https://openalex.org/A5073430888","display_name":"Alina Shitrit","orcid":"https://orcid.org/0009-0007-9489-5915","observed_orcids":["https://orcid.org/0009-0007-9489-5915"]},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"A. Shitrit","raw_affiliation_strings":[],"raw_orcid":null,"affiliations":[]},{"author_position":"middle","author":{"id":"https://openalex.org/A5036544988","display_name":"Efrat Ben\u2010Zeev","orcid":"https://orcid.org/0000-0001-9954-3248","observed_orcids":["https://orcid.org/0000-0001-9954-3248"]},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"E. Ben-Zeev","raw_affiliation_strings":[],"raw_orcid":null,"affiliations":[]},{"author_position":"middle","author":{"id":"https://openalex.org/A5040586294","display_name":"Merav Fichman","orcid":null,"observed_orcids":[]},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"M. Fichman","raw_affiliation_strings":[],"raw_orcid":null,"affiliations":[]},{"author_position":"middle","author":{"id":"https://openalex.org/A5002809267","display_name":"Y. Markus","orcid":null,"observed_orcids":[]},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"Y. Markus","raw_affiliation_strings":[],"raw_orcid":null,"affiliations":[]},{"author_position":"middle","author":{"id":"https://openalex.org/A5027640751","display_name":"Yael Marantz","orcid":null,"observed_orcids":[]},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"Y. Marantz","raw_affiliation_strings":[],"raw_orcid":null,"affiliations":[]},{"author_position":"middle","author":{"id":"https://openalex.org/A5010899423","display_name":"Hanoch Senderowitz","orcid":"https://orcid.org/0000-0003-0076-1355","observed_orcids":["https://orcid.org/0000-0003-0076-1355"]},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"H. Senderowitz","raw_affiliation_strings":[],"raw_orcid":null,"affiliations":[]},{"author_position":"last","author":{"id":"https://openalex.org/A5062925432","display_name":"Ori Kalid","orcid":null,"observed_orcids":[]},"institutions":[],"countries":[],"is_corresponding":true,"raw_author_name":"O. Kalid","raw_affiliation_strings":["8 Eybeschuts st. Tel-Aviv 62741, Israel.,Israel"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"8 Eybeschuts st. Tel-Aviv 62741, Israel.,Israel","institution_ids":[]}]}],"institutions":[],"countries_distinct_count":0,"institutions_distinct_count":0,"corresponding_author_ids":["https://openalex.org/A5004169578","https://openalex.org/A5004761084","https://openalex.org/A5062925432","https://openalex.org/A5089719407"],"corresponding_institution_ids":[],"apc_list":null,"apc_paid":null,"fwci":3.0615,"has_fulltext":false,"cited_by_count":28,"citation_normalized_percentile":{"value":0.93119552,"is_in_top_1_percent":false,"is_in_top_10_percent":true},"cited_by_percentile_year":{"min":88,"max":99},"biblio":{"volume":"10","issue":"6","first_page":"638","last_page":"656"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10211","display_name":"Computational Drug Discovery Methods","score":0.986299991607666,"subfield":{"id":"https://openalex.org/subfields/3002","display_name":"Drug Discovery"},"field":{"id":"https://openalex.org/fields/30","display_name":"Pharmacology, Toxicology and Pharmaceutics"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}},"topics":[{"id":"https://openalex.org/T10211","display_name":"Computational Drug Discovery Methods","score":0.986299991607666,"subfield":{"id":"https://openalex.org/subfields/3002","display_name":"Drug Discovery"},"field":{"id":"https://openalex.org/fields/30","display_name":"Pharmacology, Toxicology and Pharmaceutics"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}},{"id":"https://openalex.org/T11178","display_name":"Receptor Mechanisms and Signaling","score":0.012900000438094139,"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/T12576","display_name":"vaccines and immunoinformatics approaches","score":9.999999747378752e-05,"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"}}],"keywords":[{"id":"https://openalex.org/keywords/g-protein-coupled-receptors","display_name":"G protein-coupled receptors","score":0.9819999933242798},{"id":"https://openalex.org/keywords/computer-aided-drug-discovery","display_name":"computational drug discovery","score":0.9810000061988831},{"id":"https://openalex.org/keywords/structure-based-drug-design","display_name":"structure-based drug design","score":0.8330000042915344},{"id":"https://openalex.org/keywords/ligand-based-drug-design","display_name":"ligand-based drug design","score":0.9779999852180481},{"id":"https://openalex.org/keywords/virtual-screening","display_name":"virtual screening","score":0.9179999828338623},{"id":"https://openalex.org/keywords/library-design","display_name":"library design","score":0.6380000114440918},{"id":"https://openalex.org/keywords/lead-optimization","display_name":"lead optimization","score":0.7149999737739563}],"concepts":[{"id":"https://openalex.org/C2775905019","wikidata":"https://www.wikidata.org/wiki/Q192572","display_name":"In silico","level":3,"score":0.9062503576278687},{"id":"https://openalex.org/C177212765","wikidata":"https://www.wikidata.org/wiki/Q627335","display_name":"Workflow","level":2,"score":0.6321597695350647},{"id":"https://openalex.org/C74187038","wikidata":"https://www.wikidata.org/wiki/Q1418791","display_name":"Drug discovery","level":2,"score":0.6245449185371399},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.6243664026260376},{"id":"https://openalex.org/C70721500","wikidata":"https://www.wikidata.org/wiki/Q177005","display_name":"Computational biology","level":1,"score":0.6165046095848083},{"id":"https://openalex.org/C2778154381","wikidata":"https://www.wikidata.org/wiki/Q105296908","display_name":"Ingenuity","level":2,"score":0.5476188063621521},{"id":"https://openalex.org/C135285700","wikidata":"https://www.wikidata.org/wiki/Q38173","display_name":"G protein-coupled receptor","level":3,"score":0.5315321087837219},{"id":"https://openalex.org/C2780598303","wikidata":"https://www.wikidata.org/wiki/Q65921492","display_name":"Flexibility (engineering)","level":2,"score":0.5211513042449951},{"id":"https://openalex.org/C81917197","wikidata":"https://www.wikidata.org/wiki/Q628760","display_name":"Selection (genetic algorithm)","level":2,"score":0.5017597675323486},{"id":"https://openalex.org/C98045186","wikidata":"https://www.wikidata.org/wiki/Q205663","display_name":"Process (computing)","level":2,"score":0.49028280377388},{"id":"https://openalex.org/C103697762","wikidata":"https://www.wikidata.org/wiki/Q4112105","display_name":"Virtual screening","level":3,"score":0.48315781354904175},{"id":"https://openalex.org/C93453677","wikidata":"https://www.wikidata.org/wiki/Q1017580","display_name":"Business process discovery","level":5,"score":0.41836780309677124},{"id":"https://openalex.org/C2522767166","wikidata":"https://www.wikidata.org/wiki/Q2374463","display_name":"Data science","level":1,"score":0.35201317071914673},{"id":"https://openalex.org/C183696295","wikidata":"https://www.wikidata.org/wiki/Q2487696","display_name":"Biochemical engineering","level":1,"score":0.3286523222923279},{"id":"https://openalex.org/C60644358","wikidata":"https://www.wikidata.org/wiki/Q128570","display_name":"Bioinformatics","level":1,"score":0.32712942361831665},{"id":"https://openalex.org/C86803240","wikidata":"https://www.wikidata.org/wiki/Q420","display_name":"Biology","level":0,"score":0.199702650308609},{"id":"https://openalex.org/C174998907","wikidata":"https://www.wikidata.org/wiki/Q357662","display_name":"Work in process","level":2,"score":0.16807714104652405},{"id":"https://openalex.org/C127413603","wikidata":"https://www.wikidata.org/wiki/Q11023","display_name":"Engineering","level":0,"score":0.1426241099834442},{"id":"https://openalex.org/C119857082","wikidata":"https://www.wikidata.org/wiki/Q2539","display_name":"Machine learning","level":1,"score":0.11792504787445068},{"id":"https://openalex.org/C77088390","wikidata":"https://www.wikidata.org/wiki/Q8513","display_name":"Database","level":1,"score":0.1049257218837738},{"id":"https://openalex.org/C133425853","wikidata":"https://www.wikidata.org/wiki/Q60571","display_name":"Neoclassical economics","level":1,"score":0.0},{"id":"https://openalex.org/C105795698","wikidata":"https://www.wikidata.org/wiki/Q12483","display_name":"Statistics","level":1,"score":0.0},{"id":"https://openalex.org/C111919701","wikidata":"https://www.wikidata.org/wiki/Q9135","display_name":"Operating system","level":1,"score":0.0},{"id":"https://openalex.org/C85345410","wikidata":"https://www.wikidata.org/wiki/Q851587","display_name":"Business process","level":3,"score":0.0},{"id":"https://openalex.org/C162324750","wikidata":"https://www.wikidata.org/wiki/Q8134","display_name":"Economics","level":0,"score":0.0},{"id":"https://openalex.org/C104317684","wikidata":"https://www.wikidata.org/wiki/Q7187","display_name":"Gene","level":2,"score":0.0},{"id":"https://openalex.org/C207505557","wikidata":"https://www.wikidata.org/wiki/Q4374012","display_name":"Business process modeling","level":4,"score":0.0},{"id":"https://openalex.org/C21547014","wikidata":"https://www.wikidata.org/wiki/Q1423657","display_name":"Operations management","level":1,"score":0.0},{"id":"https://openalex.org/C170493617","wikidata":"https://www.wikidata.org/wiki/Q208467","display_name":"Receptor","level":2,"score":0.0},{"id":"https://openalex.org/C55493867","wikidata":"https://www.wikidata.org/wiki/Q7094","display_name":"Biochemistry","level":1,"score":0.0},{"id":"https://openalex.org/C33923547","wikidata":"https://www.wikidata.org/wiki/Q395","display_name":"Mathematics","level":0,"score":0.0}],"mesh":[{"descriptor_ui":"D008024","descriptor_name":"Ligands","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008958","descriptor_name":"Models, Molecular","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D013329","descriptor_name":"Structure-Activity Relationship","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D015195","descriptor_name":"Drug Design","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D043562","descriptor_name":"Receptors, G-Protein-Coupled","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":true},{"descriptor_ui":"D055808","descriptor_name":"Drug Discovery","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true}],"locations_count":2,"locations":[{"id":"doi:10.2174/156802610791111498","doi":"https://doi.org/10.2174/156802610791111498","is_oa":false,"landing_page_url":"https://doi.org/10.2174/156802610791111498","pdf_url":null,"source":{"id":"https://openalex.org/S107732428","display_name":"Current Topics in Medicinal Chemistry","issn_l":"1568-0266","issn":["1568-0266","1873-4294"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","jufo-1","ki-jl-1","medline","norway-1","poland-100","russia-white-list-1"],"host_organization":"https://openalex.org/P4310320079","host_organization_name":"Bentham Science Publishers","host_organization_lineage":["https://openalex.org/P4310320079"],"host_organization_lineage_names":["Bentham Science Publishers"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Current Topics in Medicinal Chemistry","raw_type":"journal-article"},{"id":"pmid:20337589","doi":null,"is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/20337589","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,"listed_in":[],"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":"Current topics in medicinal chemistry","raw_type":"Journal Article"}],"best_oa_location":null,"sustainable_development_goals":[],"study_designs":[],"awards":[],"funders":[],"has_content":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":0,"referenced_works":[],"related_works":["https://openalex.org/W1971417560","https://openalex.org/W2003194288","https://openalex.org/W2123563726","https://openalex.org/W1984352342","https://openalex.org/W1170028849","https://openalex.org/W2559036047","https://openalex.org/W2021867283","https://openalex.org/W2094205066","https://openalex.org/W2618932375","https://openalex.org/W3042958168"],"abstract_inverted_index":{"In":[0],"silico":[1,24,45,84],"drug":[2,25],"discovery":[3,26],"is":[4,60],"a":[5,16],"complex":[6],"process":[7,68,87],"requiring":[8],"flexibility":[9],"and":[10,15,55,70,86,99],"ingenuity":[11],"in":[12,23,44,49,83],"method":[13],"selection":[14,72],"careful":[17],"validation":[18,69],"of":[19,34,107],"work":[20],"protocols.":[21],"GPCR":[22,43],"poses":[27],"additional":[28],"challenges":[29],"due":[30],"to":[31,62,92],"the":[32,50,108],"paucity":[33],"crystallographic":[35],"data.":[36],"This":[37],"paper":[38],"starts":[39],"by":[40,114],"reviewing":[41],"selected":[42],"screening":[46,98],"programs":[47,102,118],"reported":[48],"literature,":[51],"including":[52],"both":[53],"structure-based":[54],"ligand-based":[56],"approaches.":[57],"Particular":[58],"emphasis":[59],"given":[61],"library":[63],"design,":[64],"binding":[65],"mode":[66],"selection,":[67],"compound":[71],"for":[73],"biological":[74],"testing.":[75],"Following":[76],"literature":[77],"review,":[78],"we":[79],"provide":[80],"insights":[81],"into":[82],"methodologies":[85,110],"workflows":[88],"used":[89],"at":[90],"EPIX":[91],"drive":[93],"over":[94],"20":[95],"highly":[96],"successful":[97],"lead":[100],"optimization":[101],"performed":[103],"since":[104],"2001.":[105],"Applications":[106],"various":[109],"discussed":[111],"are":[112],"demonstrated":[113],"examples":[115],"from":[116],"recent":[117],"that":[119],"have":[120],"not":[121],"yet":[122],"been":[123],"published.":[124]},"counts_by_year":[{"year":2024,"cited_by_count":1},{"year":2022,"cited_by_count":1},{"year":2020,"cited_by_count":1},{"year":2018,"cited_by_count":1},{"year":2015,"cited_by_count":1},{"year":2014,"cited_by_count":1},{"year":2013,"cited_by_count":5},{"year":2012,"cited_by_count":7}],"updated_date":"2026-11-07T11:25:07.637180","created_date":"2016-06-24T00:00:00"}
