{"id":"https://openalex.org/W2755568798","doi":"https://doi.org/10.1021/acs.jcim.7b00435","title":"Privileged Substructures to Modulate Protein\u2013Protein Interactions","display_name":"Privileged Substructures to Modulate Protein\u2013Protein Interactions","publication_year":2017,"publication_date":"2017-09-18","ids":{"openalex":"https://openalex.org/W2755568798","doi":"https://doi.org/10.1021/acs.jcim.7b00435","mag":"2755568798"},"language":"en","primary_location":{"id":"doi:10.1021/acs.jcim.7b00435","is_oa":false,"landing_page_url":"https://doi.org/10.1021/acs.jcim.7b00435","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"],"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/A5070971590","display_name":"Nicolas Bosc","orcid":"https://orcid.org/0000-0003-3562-1328"},"institutions":[{"id":"https://openalex.org/I157536573","display_name":"Institut Pasteur","ror":"https://ror.org/0495fxg12","country_code":"FR","type":"funder","lineage":["https://openalex.org/I157536573"]},{"id":"https://openalex.org/I169173203","display_name":"D\u00e9l\u00e9gation Paris 7","ror":"https://ror.org/00bw5n526","country_code":"FR","type":"government","lineage":["https://openalex.org/I154526488","https://openalex.org/I169173203"]},{"id":"https://openalex.org/I4210091437","display_name":"Sorbonne Paris Cit\u00e9","ror":"https://ror.org/001z21q04","country_code":"FR","type":"other","lineage":["https://openalex.org/I4210091437"]},{"id":"https://openalex.org/I1294671590","display_name":"Centre National de la Recherche Scientifique","ror":"https://ror.org/02feahw73","country_code":"FR","type":"funder","lineage":["https://openalex.org/I1294671590"]},{"id":"https://openalex.org/I154526488","display_name":"Inserm","ror":"https://ror.org/02vjkv261","country_code":"FR","type":"funder","lineage":["https://openalex.org/I154526488"]},{"id":"https://openalex.org/I204730241","display_name":"Universit\u00e9 Paris Cit\u00e9","ror":"https://ror.org/05f82e368","country_code":"FR","type":"education","lineage":["https://openalex.org/I204730241"]}],"countries":["FR"],"is_corresponding":true,"raw_author_name":"Nicolas Bosc","raw_affiliation_strings":["CNRS UMR3528, Institut Pasteur, 25-28 rue du Dr Roux, Paris 75015, France","Inserm, U973, Paris 75013, France","Structural Bioinformatics Unit, Department of Structural Biology\rand Chemistry, Institut Pasteur, 25-28 rue du Dr Roux, Paris 75015, France","Universit\u00e9 Paris Diderot, Sorbonne Paris Cit\u00e9, UMRS 973 Inserm, Paris 75013, France"],"affiliations":[{"raw_affiliation_string":"CNRS UMR3528, Institut Pasteur, 25-28 rue du Dr Roux, Paris 75015, France","institution_ids":["https://openalex.org/I157536573","https://openalex.org/I1294671590"]},{"raw_affiliation_string":"Inserm, U973, Paris 75013, France","institution_ids":["https://openalex.org/I154526488"]},{"raw_affiliation_string":"Structural Bioinformatics Unit, Department of Structural Biology\rand Chemistry, Institut Pasteur, 25-28 rue du Dr Roux, Paris 75015, France","institution_ids":["https://openalex.org/I157536573"]},{"raw_affiliation_string":"Universit\u00e9 Paris Diderot, Sorbonne Paris Cit\u00e9, UMRS 973 Inserm, Paris 75013, France","institution_ids":["https://openalex.org/I169173203","https://openalex.org/I154526488","https://openalex.org/I4210091437","https://openalex.org/I204730241"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5078099175","display_name":"M\u00e9laine A. Kuenemann","orcid":"https://orcid.org/0000-0001-5317-2111"},"institutions":[{"id":"https://openalex.org/I204730241","display_name":"Universit\u00e9 Paris Cit\u00e9","ror":"https://ror.org/05f82e368","country_code":"FR","type":"education","lineage":["https://openalex.org/I204730241"]},{"id":"https://openalex.org/I4210091437","display_name":"Sorbonne Paris Cit\u00e9","ror":"https://ror.org/001z21q04","country_code":"FR","type":"other","lineage":["https://openalex.org/I4210091437"]},{"id":"https://openalex.org/I154526488","display_name":"Inserm","ror":"https://ror.org/02vjkv261","country_code":"FR","type":"funder","lineage":["https://openalex.org/I154526488"]},{"id":"https://openalex.org/I169173203","display_name":"D\u00e9l\u00e9gation Paris 7","ror":"https://ror.org/00bw5n526","country_code":"FR","type":"government","lineage":["https://openalex.org/I154526488","https://openalex.org/I169173203"]}],"countries":["FR"],"is_corresponding":false,"raw_author_name":"M\u00e9laine A. Kuenemann","raw_affiliation_strings":["Inserm, U973, Paris 75013, France","Universit\u00e9 Paris Diderot, Sorbonne Paris Cit\u00e9, UMRS 973 Inserm, Paris 75013, France"],"affiliations":[{"raw_affiliation_string":"Inserm, U973, Paris 75013, France","institution_ids":["https://openalex.org/I154526488"]},{"raw_affiliation_string":"Universit\u00e9 Paris Diderot, Sorbonne Paris Cit\u00e9, UMRS 973 Inserm, Paris 75013, France","institution_ids":["https://openalex.org/I169173203","https://openalex.org/I154526488","https://openalex.org/I4210091437","https://openalex.org/I204730241"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5069811694","display_name":"J\u00e9r\u00f4me Becot","orcid":null},"institutions":[{"id":"https://openalex.org/I169173203","display_name":"D\u00e9l\u00e9gation Paris 7","ror":"https://ror.org/00bw5n526","country_code":"FR","type":"government","lineage":["https://openalex.org/I154526488","https://openalex.org/I169173203"]},{"id":"https://openalex.org/I204730241","display_name":"Universit\u00e9 Paris Cit\u00e9","ror":"https://ror.org/05f82e368","country_code":"FR","type":"education","lineage":["https://openalex.org/I204730241"]},{"id":"https://openalex.org/I4210091437","display_name":"Sorbonne Paris Cit\u00e9","ror":"https://ror.org/001z21q04","country_code":"FR","type":"other","lineage":["https://openalex.org/I4210091437"]},{"id":"https://openalex.org/I154526488","display_name":"Inserm","ror":"https://ror.org/02vjkv261","country_code":"FR","type":"funder","lineage":["https://openalex.org/I154526488"]}],"countries":["FR"],"is_corresponding":false,"raw_author_name":"Jerome B\u00e9cot","raw_affiliation_strings":["Inserm, U973, Paris 75013, France","Universit\u00e9 Paris Diderot, Sorbonne Paris Cit\u00e9, UMRS 973 Inserm, Paris 75013, France"],"affiliations":[{"raw_affiliation_string":"Inserm, U973, Paris 75013, France","institution_ids":["https://openalex.org/I154526488"]},{"raw_affiliation_string":"Universit\u00e9 Paris Diderot, Sorbonne Paris Cit\u00e9, UMRS 973 Inserm, Paris 75013, France","institution_ids":["https://openalex.org/I169173203","https://openalex.org/I154526488","https://openalex.org/I4210091437","https://openalex.org/I204730241"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5034532685","display_name":"Marek Vavru\u0161a","orcid":null},"institutions":[{"id":"https://openalex.org/I169173203","display_name":"D\u00e9l\u00e9gation Paris 7","ror":"https://ror.org/00bw5n526","country_code":"FR","type":"government","lineage":["https://openalex.org/I154526488","https://openalex.org/I169173203"]},{"id":"https://openalex.org/I154526488","display_name":"Inserm","ror":"https://ror.org/02vjkv261","country_code":"FR","type":"funder","lineage":["https://openalex.org/I154526488"]},{"id":"https://openalex.org/I4210091437","display_name":"Sorbonne Paris Cit\u00e9","ror":"https://ror.org/001z21q04","country_code":"FR","type":"other","lineage":["https://openalex.org/I4210091437"]},{"id":"https://openalex.org/I204730241","display_name":"Universit\u00e9 Paris Cit\u00e9","ror":"https://ror.org/05f82e368","country_code":"FR","type":"education","lineage":["https://openalex.org/I204730241"]}],"countries":["FR"],"is_corresponding":false,"raw_author_name":"Marek Vavrusa","raw_affiliation_strings":["Inserm, U973, Paris 75013, France","Universit\u00e9 Paris Diderot, Sorbonne Paris Cit\u00e9, UMRS 973 Inserm, Paris 75013, France"],"affiliations":[{"raw_affiliation_string":"Inserm, U973, Paris 75013, France","institution_ids":["https://openalex.org/I154526488"]},{"raw_affiliation_string":"Universit\u00e9 Paris Diderot, Sorbonne Paris Cit\u00e9, UMRS 973 Inserm, Paris 75013, France","institution_ids":["https://openalex.org/I169173203","https://openalex.org/I154526488","https://openalex.org/I4210091437","https://openalex.org/I204730241"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5033244568","display_name":"Adrien Henri Cerdan","orcid":"https://orcid.org/0000-0001-6953-8325"},"institutions":[{"id":"https://openalex.org/I169173203","display_name":"D\u00e9l\u00e9gation Paris 7","ror":"https://ror.org/00bw5n526","country_code":"FR","type":"government","lineage":["https://openalex.org/I154526488","https://openalex.org/I169173203"]},{"id":"https://openalex.org/I204730241","display_name":"Universit\u00e9 Paris Cit\u00e9","ror":"https://ror.org/05f82e368","country_code":"FR","type":"education","lineage":["https://openalex.org/I204730241"]},{"id":"https://openalex.org/I154526488","display_name":"Inserm","ror":"https://ror.org/02vjkv261","country_code":"FR","type":"funder","lineage":["https://openalex.org/I154526488"]},{"id":"https://openalex.org/I4210091437","display_name":"Sorbonne Paris Cit\u00e9","ror":"https://ror.org/001z21q04","country_code":"FR","type":"other","lineage":["https://openalex.org/I4210091437"]}],"countries":["FR"],"is_corresponding":false,"raw_author_name":"Adrien H. Cerdan","raw_affiliation_strings":["Inserm, U973, Paris 75013, France","Universit\u00e9 Paris Diderot, Sorbonne Paris Cit\u00e9, UMRS 973 Inserm, Paris 75013, France"],"affiliations":[{"raw_affiliation_string":"Inserm, U973, Paris 75013, France","institution_ids":["https://openalex.org/I154526488"]},{"raw_affiliation_string":"Universit\u00e9 Paris Diderot, Sorbonne Paris Cit\u00e9, UMRS 973 Inserm, Paris 75013, France","institution_ids":["https://openalex.org/I169173203","https://openalex.org/I154526488","https://openalex.org/I4210091437","https://openalex.org/I204730241"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5064154680","display_name":"Olivier Sp\u00e9randio","orcid":"https://orcid.org/0000-0001-6610-2729"},"institutions":[{"id":"https://openalex.org/I154526488","display_name":"Inserm","ror":"https://ror.org/02vjkv261","country_code":"FR","type":"funder","lineage":["https://openalex.org/I154526488"]},{"id":"https://openalex.org/I1294671590","display_name":"Centre National de la Recherche Scientifique","ror":"https://ror.org/02feahw73","country_code":"FR","type":"funder","lineage":["https://openalex.org/I1294671590"]},{"id":"https://openalex.org/I169173203","display_name":"D\u00e9l\u00e9gation Paris 7","ror":"https://ror.org/00bw5n526","country_code":"FR","type":"government","lineage":["https://openalex.org/I154526488","https://openalex.org/I169173203"]},{"id":"https://openalex.org/I157536573","display_name":"Institut Pasteur","ror":"https://ror.org/0495fxg12","country_code":"FR","type":"funder","lineage":["https://openalex.org/I157536573"]},{"id":"https://openalex.org/I4210091437","display_name":"Sorbonne Paris Cit\u00e9","ror":"https://ror.org/001z21q04","country_code":"FR","type":"other","lineage":["https://openalex.org/I4210091437"]},{"id":"https://openalex.org/I204730241","display_name":"Universit\u00e9 Paris Cit\u00e9","ror":"https://ror.org/05f82e368","country_code":"FR","type":"education","lineage":["https://openalex.org/I204730241"]}],"countries":["FR"],"is_corresponding":false,"raw_author_name":"Olivier Sperandio","raw_affiliation_strings":["CNRS UMR3528, Institut Pasteur, 25-28 rue du Dr Roux, Paris 75015, France","Inserm, U973, Paris 75013, France","Structural Bioinformatics Unit, Department of Structural Biology\rand Chemistry, Institut Pasteur, 25-28 rue du Dr Roux, Paris 75015, France","Universit\u00e9 Paris Diderot, Sorbonne Paris Cit\u00e9, UMRS 973 Inserm, Paris 75013, France"],"affiliations":[{"raw_affiliation_string":"CNRS UMR3528, Institut Pasteur, 25-28 rue du Dr Roux, Paris 75015, France","institution_ids":["https://openalex.org/I157536573","https://openalex.org/I1294671590"]},{"raw_affiliation_string":"Inserm, U973, Paris 75013, France","institution_ids":["https://openalex.org/I154526488"]},{"raw_affiliation_string":"Structural Bioinformatics Unit, Department of Structural Biology\rand Chemistry, Institut Pasteur, 25-28 rue du Dr Roux, Paris 75015, France","institution_ids":["https://openalex.org/I157536573"]},{"raw_affiliation_string":"Universit\u00e9 Paris Diderot, Sorbonne Paris Cit\u00e9, UMRS 973 Inserm, Paris 75013, France","institution_ids":["https://openalex.org/I169173203","https://openalex.org/I154526488","https://openalex.org/I4210091437","https://openalex.org/I204730241"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":6,"corresponding_author_ids":["https://openalex.org/A5070971590"],"corresponding_institution_ids":["https://openalex.org/I1294671590","https://openalex.org/I154526488","https://openalex.org/I157536573","https://openalex.org/I169173203","https://openalex.org/I204730241","https://openalex.org/I4210091437"],"apc_list":null,"apc_paid":null,"fwci":1.1356,"has_fulltext":false,"cited_by_count":7,"citation_normalized_percentile":{"value":0.80514314,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":89,"max":97},"biblio":{"volume":"57","issue":"10","first_page":"2448","last_page":"2462"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10211","display_name":"Computational Drug Discovery Methods","score":0.9998000264167786,"subfield":{"id":"https://openalex.org/subfields/1703","display_name":"Computational Theory and Mathematics"},"field":{"id":"https://openalex.org/fields/17","display_name":"Computer Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T10211","display_name":"Computational Drug Discovery Methods","score":0.9998000264167786,"subfield":{"id":"https://openalex.org/subfields/1703","display_name":"Computational Theory and Mathematics"},"field":{"id":"https://openalex.org/fields/17","display_name":"Computer Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T10252","display_name":"Microbial Natural Products and Biosynthesis","score":0.993399977684021,"subfield":{"id":"https://openalex.org/subfields/2736","display_name":"Pharmacology"},"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/T11440","display_name":"Click Chemistry and Applications","score":0.9872999787330627,"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/computational-biology","display_name":"Computational biology","score":0.5225569605827332},{"id":"https://openalex.org/keywords/computer-science","display_name":"Computer science","score":0.5163156390190125},{"id":"https://openalex.org/keywords/chemical-biology","display_name":"Chemical biology","score":0.473537415266037},{"id":"https://openalex.org/keywords/data-science","display_name":"Data science","score":0.4707879424095154},{"id":"https://openalex.org/keywords/set","display_name":"Set (abstract data type)","score":0.43326735496520996},{"id":"https://openalex.org/keywords/chemistry","display_name":"Chemistry","score":0.3913605213165283},{"id":"https://openalex.org/keywords/nanotechnology","display_name":"Nanotechnology","score":0.3349422216415405},{"id":"https://openalex.org/keywords/combinatorial-chemistry","display_name":"Combinatorial chemistry","score":0.32381725311279297},{"id":"https://openalex.org/keywords/biology","display_name":"Biology","score":0.20258980989456177},{"id":"https://openalex.org/keywords/biochemistry","display_name":"Biochemistry","score":0.1663564145565033},{"id":"https://openalex.org/keywords/materials-science","display_name":"Materials science","score":0.1546034812927246}],"concepts":[{"id":"https://openalex.org/C70721500","wikidata":"https://www.wikidata.org/wiki/Q177005","display_name":"Computational biology","level":1,"score":0.5225569605827332},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.5163156390190125},{"id":"https://openalex.org/C171852809","wikidata":"https://www.wikidata.org/wiki/Q731154","display_name":"Chemical biology","level":2,"score":0.473537415266037},{"id":"https://openalex.org/C2522767166","wikidata":"https://www.wikidata.org/wiki/Q2374463","display_name":"Data science","level":1,"score":0.4707879424095154},{"id":"https://openalex.org/C177264268","wikidata":"https://www.wikidata.org/wiki/Q1514741","display_name":"Set (abstract data type)","level":2,"score":0.43326735496520996},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.3913605213165283},{"id":"https://openalex.org/C171250308","wikidata":"https://www.wikidata.org/wiki/Q11468","display_name":"Nanotechnology","level":1,"score":0.3349422216415405},{"id":"https://openalex.org/C21951064","wikidata":"https://www.wikidata.org/wiki/Q899212","display_name":"Combinatorial chemistry","level":1,"score":0.32381725311279297},{"id":"https://openalex.org/C86803240","wikidata":"https://www.wikidata.org/wiki/Q420","display_name":"Biology","level":0,"score":0.20258980989456177},{"id":"https://openalex.org/C55493867","wikidata":"https://www.wikidata.org/wiki/Q7094","display_name":"Biochemistry","level":1,"score":0.1663564145565033},{"id":"https://openalex.org/C192562407","wikidata":"https://www.wikidata.org/wiki/Q228736","display_name":"Materials science","level":0,"score":0.1546034812927246},{"id":"https://openalex.org/C199360897","wikidata":"https://www.wikidata.org/wiki/Q9143","display_name":"Programming language","level":1,"score":0.0}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1021/acs.jcim.7b00435","is_oa":false,"landing_page_url":"https://doi.org/10.1021/acs.jcim.7b00435","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"}],"best_oa_location":null,"sustainable_development_goals":[],"awards":[{"id":"https://openalex.org/G1757366511","display_name":null,"funder_award_id":"ANR-15-CE18-0023-03","funder_id":"https://openalex.org/F4320320883","funder_display_name":"Agence Nationale de la Recherche"}],"funders":[{"id":"https://openalex.org/F4320320883","display_name":"Agence Nationale de la Recherche","ror":"https://ror.org/00rbzpz17"},{"id":"https://openalex.org/F4320321026","display_name":"Ministry of Earth Sciences","ror":"https://ror.org/013cf5k59"},{"id":"https://openalex.org/F4320322724","display_name":"Ministry of Education, India","ror":"https://ror.org/048xjjh50"}],"has_content":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":51,"referenced_works":["https://openalex.org/W1831050183","https://openalex.org/W1964288351","https://openalex.org/W1975323048","https://openalex.org/W1975875968","https://openalex.org/W1979814868","https://openalex.org/W1980621088","https://openalex.org/W1992006348","https://openalex.org/W1993591356","https://openalex.org/W1995833243","https://openalex.org/W2018745394","https://openalex.org/W2027482274","https://openalex.org/W2028326521","https://openalex.org/W2030616940","https://openalex.org/W2038359277","https://openalex.org/W2043509228","https://openalex.org/W2045722951","https://openalex.org/W2047314546","https://openalex.org/W2053548662","https://openalex.org/W2054291223","https://openalex.org/W2059664977","https://openalex.org/W2060531713","https://openalex.org/W2067305633","https://openalex.org/W2069126953","https://openalex.org/W2074557538","https://openalex.org/W2074964005","https://openalex.org/W2081320767","https://openalex.org/W2083441741","https://openalex.org/W2089868118","https://openalex.org/W2096864392","https://openalex.org/W2121666644","https://openalex.org/W2125055259","https://openalex.org/W2128247932","https://openalex.org/W2133990480","https://openalex.org/W2137801157","https://openalex.org/W2138314961","https://openalex.org/W2142178021","https://openalex.org/W2162106505","https://openalex.org/W2168363281","https://openalex.org/W2214316343","https://openalex.org/W2227799525","https://openalex.org/W2284409061","https://openalex.org/W2318657222","https://openalex.org/W2320170875","https://openalex.org/W2325357042","https://openalex.org/W2329592726","https://openalex.org/W2519076632","https://openalex.org/W2582743722","https://openalex.org/W2586253560","https://openalex.org/W2911964244","https://openalex.org/W4239510810","https://openalex.org/W4248232688"],"related_works":["https://openalex.org/W2114733818","https://openalex.org/W1522641714","https://openalex.org/W1995751404","https://openalex.org/W4232457045","https://openalex.org/W2073459472","https://openalex.org/W2413881810","https://openalex.org/W2915460664","https://openalex.org/W1967477110","https://openalex.org/W4225984933","https://openalex.org/W2043147644"],"abstract_inverted_index":{"Given":[0],"the":[1,15,22,37,80,103],"difficulties":[2],"to":[3,19,24,41,75,142],"identify":[4,143],"chemical":[5,28,58,77,108,131,146],"probes":[6,147],"that":[7,60,110,129],"can":[8,111],"modulate":[9],"protein\u2013protein":[10],"interactions":[11],"(PPIs),":[12],"actors":[13],"in":[14,102,139],"field":[16],"have":[17,52],"started":[18],"agree":[20],"on":[21,148],"necessity":[23],"use":[25],"PPI-tailored":[26],"screening":[27],"collections.":[29],"However,":[30],"which":[31],"type":[32],"of":[33,39,56,67,82,92,99,105],"scaffolds":[34,106],"may":[35],"promote":[36],"binding":[38],"compounds":[40],"PPI":[42,149],"targets":[43],"remains":[44],"unclear.":[45],"In":[46],"this":[47],"big":[48],"data":[49,90],"analysis,":[50],"we":[51,95],"identified":[53],"a":[54,73,86,97],"list":[55,98],"privileged":[57,100],"substructures":[59,78,101],"are":[61],"most":[62],"often":[63],"observed":[64],"within":[65],"inhibitors":[66],"PPIs.":[68],"Using":[69],"molecular":[70],"frameworks":[71],"as":[72],"way":[74],"perceive":[76],"with":[79],"combination":[81],"an":[83],"experimental":[84],"and":[85,107,116],"machine-learning":[87],"based":[88],"predicted":[89],"set":[91],"iPPI":[93],"compounds,":[94],"propose":[96],"form":[104],"moieties":[109],"be":[112,134],"substantially":[113],"chemically":[114],"functionalized":[115],"do":[117],"not":[118],"present":[119],"any":[120],"toxicophore":[121],"nor":[122],"pan-assay":[123],"interference":[124],"(PAINS)":[125],"alerts.":[126],"We":[127],"think":[128],"such":[130],"guidance":[132],"will":[133],"valuable":[135],"for":[136],"medicinal":[137],"chemists":[138],"their":[140],"attempt":[141],"initial":[144],"quality":[145],"targets.":[150]},"counts_by_year":[{"year":2022,"cited_by_count":1},{"year":2021,"cited_by_count":1},{"year":2020,"cited_by_count":4},{"year":2019,"cited_by_count":1}],"updated_date":"2025-11-06T03:46:38.306776","created_date":"2017-09-25T00:00:00"}
