{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,9,24]],"date-time":"2026-09-24T22:44:12Z","timestamp":1790289852044,"version":"4.1.0"},"reference-count":77,"publisher":"American Chemical Society (ACS)","issue":"11","content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Med. Chem."],"published-print":{"date-parts":[[2012,6,14]]},"DOI":"10.1021\/jm300280e","type":"journal-article","created":{"date-parts":[[2012,5,7]],"date-time":"2012-05-07T13:36:11Z","timestamp":1336397771000},"page":"5311-5325","source":"Crossref","is-referenced-by-count":30,"title":["A Prospective Cross-Screening Study on G-Protein-Coupled Receptors: Lessons Learned in Virtual Compound Library Design"],"prefix":"10.1021","volume":"55","author":[{"given":"Marijn P. A.","family":"Sanders","sequence":"first","affiliation":[{"name":"Computational Drug Discovery Group, Radboud University Nijmegen Medical Centre, Geert Grooteplein,\rNijmegen, The Netherlands"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Luc","family":"Roumen","sequence":"additional","affiliation":[{"name":"Leiden\/Amsterdam Center of Drug Research (LACDR), Division of Medicinal\rChemistry, Faculty of Sciences, VU University Amsterdam, De Boelelaan 1083, 1081 HV Amsterdam, The Netherlands"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Eelke","family":"van der Horst","sequence":"additional","affiliation":[{"name":"Leiden\/Amsterdam Center of Drug Research\r(LACDR), Division of Medicinal Chemistry, Leiden University, Einsteinweg 55, 2333 CC Leiden, The Netherlands"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"J. Robert","family":"Lane","sequence":"additional","affiliation":[{"name":"Leiden\/Amsterdam Center of Drug Research\r(LACDR), Division of Medicinal Chemistry, Leiden University, Einsteinweg 55, 2333 CC Leiden, The Netherlands"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Henry F.","family":"Vischer","sequence":"additional","affiliation":[{"name":"Leiden\/Amsterdam Center of Drug Research (LACDR), Division of Medicinal\rChemistry, Faculty of Sciences, VU University Amsterdam, De Boelelaan 1083, 1081 HV Amsterdam, The Netherlands"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Jody","family":"van Offenbeek","sequence":"additional","affiliation":[{"name":"Leiden\/Amsterdam Center of Drug Research (LACDR), Division of Medicinal\rChemistry, Faculty of Sciences, VU University Amsterdam, De Boelelaan 1083, 1081 HV Amsterdam, The Netherlands"},{"name":"Department of Molecular Pharmacology and DMPK, MSD, Molenstraat 110, 5342 CC Oss, The Netherlands"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Henk","family":"de Vries","sequence":"additional","affiliation":[{"name":"Leiden\/Amsterdam Center of Drug Research\r(LACDR), Division of Medicinal Chemistry, Leiden University, Einsteinweg 55, 2333 CC Leiden, The Netherlands"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Stefan","family":"Verhoeven","sequence":"additional","affiliation":[{"name":"Department of Molecular Design\rand Informatics, MSD, Molenstraat 110,\r5342 CC Oss, The Netherlands"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Ken Y.","family":"Chow","sequence":"additional","affiliation":[{"name":"Leiden\/Amsterdam Center of Drug Research (LACDR), Division of Medicinal\rChemistry, Faculty of Sciences, VU University Amsterdam, De Boelelaan 1083, 1081 HV Amsterdam, The Netherlands"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Folkert","family":"Verkaar","sequence":"additional","affiliation":[{"name":"Leiden\/Amsterdam Center of Drug Research (LACDR), Division of Medicinal\rChemistry, Faculty of Sciences, VU University Amsterdam, De Boelelaan 1083, 1081 HV Amsterdam, The Netherlands"},{"name":"Department of Molecular Pharmacology and DMPK, MSD, Molenstraat 110, 5342 CC Oss, The Netherlands"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Margot W.","family":"Beukers","sequence":"additional","affiliation":[{"name":"Leiden\/Amsterdam Center of Drug Research\r(LACDR), Division of Medicinal Chemistry, Leiden University, Einsteinweg 55, 2333 CC Leiden, The Netherlands"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Ross","family":"McGuire","sequence":"additional","affiliation":[{"name":"Department of Molecular Design\rand Informatics, MSD, Molenstraat 110,\r5342 CC Oss, The Netherlands"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Rob","family":"Leurs","sequence":"additional","affiliation":[{"name":"Leiden\/Amsterdam Center of Drug Research (LACDR), Division of Medicinal\rChemistry, Faculty of Sciences, VU University Amsterdam, De Boelelaan 1083, 1081 HV Amsterdam, The Netherlands"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Adriaan P.","family":"IJzerman","sequence":"additional","affiliation":[{"name":"Leiden\/Amsterdam Center of Drug Research\r(LACDR), Division of Medicinal Chemistry, Leiden University, Einsteinweg 55, 2333 CC Leiden, The Netherlands"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Jacob","family":"de Vlieg","sequence":"additional","affiliation":[{"name":"Computational Drug Discovery Group, Radboud University Nijmegen Medical Centre, Geert Grooteplein,\rNijmegen, The Netherlands"},{"name":"Department of Molecular Design\rand Informatics, MSD, Molenstraat 110,\r5342 CC Oss, The Netherlands"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Iwan J. P.","family":"de Esch","sequence":"additional","affiliation":[{"name":"Leiden\/Amsterdam Center of Drug Research (LACDR), Division of Medicinal\rChemistry, Faculty of Sciences, VU University Amsterdam, De Boelelaan 1083, 1081 HV Amsterdam, The Netherlands"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Guido J. R.","family":"Zaman","sequence":"additional","affiliation":[{"name":"Department of Molecular Pharmacology and DMPK, MSD, Molenstraat 110, 5342 CC Oss, The Netherlands"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Jan P. G.","family":"Klomp","sequence":"additional","affiliation":[{"name":"Department of Molecular Design\rand Informatics, MSD, Molenstraat 110,\r5342 CC Oss, The Netherlands"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Andreas","family":"Bender","sequence":"additional","affiliation":[{"name":"Leiden\/Amsterdam Center of Drug Research\r(LACDR), Division of Medicinal Chemistry, Leiden University, Einsteinweg 55, 2333 CC Leiden, The Netherlands"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Chris","family":"de Graaf","sequence":"additional","affiliation":[{"name":"Leiden\/Amsterdam Center of Drug Research (LACDR), Division of Medicinal\rChemistry, Faculty of Sciences, VU University Amsterdam, De Boelelaan 1083, 1081 HV Amsterdam, The Netherlands"}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"316","published-online":{"date-parts":[[2012,5,23]]},"reference":[{"key":"ref1\/cit1","doi-asserted-by":"crossref","DOI":"10.1002\/3527603948","volume-title":"Chemogenomics in Drug Discovery: A Medicinal Chemistry Perspective","author":"Kubinyi H.","year":"2004"},{"key":"ref2\/cit2","doi-asserted-by":"crossref","first-page":"262","DOI":"10.1038\/nrg1317","volume":"5","author":"Bredel M.","year":"2004","journal-title":"Nat. Rev. Genet."},{"key":"ref3\/cit3","doi-asserted-by":"crossref","first-page":"880","DOI":"10.1016\/j.drudis.2006.08.013","volume":"11","author":"Harris C. J.","year":"2006","journal-title":"Drug Discovery Today"},{"key":"ref4\/cit4","doi-asserted-by":"crossref","first-page":"464","DOI":"10.1016\/S1367-5931(00)00229-5","volume":"5","author":"Caron P. R.","year":"2001","journal-title":"Curr. Opin. Chem. Biol."},{"key":"ref5\/cit5","doi-asserted-by":"crossref","first-page":"38","DOI":"10.1038\/sj.bjp.0707307","volume":"152","author":"Rognan D.","year":"2007","journal-title":"Br. J. Pharmacol."},{"key":"ref6\/cit6","doi-asserted-by":"crossref","first-page":"176","DOI":"10.1002\/minf.200900081","volume":"29","author":"Rognan D.","year":"2010","journal-title":"Mol. Inf."},{"key":"ref7\/cit7","doi-asserted-by":"crossref","first-page":"175","DOI":"10.1038\/nature08506","volume":"462","author":"Keiser M. J.","year":"2009","journal-title":"Nature"},{"key":"ref8\/cit8","doi-asserted-by":"crossref","first-page":"840","DOI":"10.2174\/138620711797537102","volume":"14","author":"Badrinarayan P.","year":"2011","journal-title":"Comb. Chem. High Throughput Screening"},{"key":"ref9\/cit9","first-page":"298","volume":"10","author":"Seifert M. H.","year":"2007","journal-title":"Curr. Opin. Drug Discovery Dev."},{"key":"ref10\/cit10","doi-asserted-by":"crossref","first-page":"329","DOI":"10.2174\/138920307781369427","volume":"8","author":"Reddy A. S.","year":"2007","journal-title":"Curr. Protein Pept. Sci."},{"key":"ref11\/cit11","doi-asserted-by":"crossref","first-page":"1956","DOI":"10.2174\/156802611796391285","volume":"11","author":"Brianso F.","year":"2011","journal-title":"Curr. Top. Med. Chem."},{"key":"ref12\/cit12","doi-asserted-by":"crossref","first-page":"983","DOI":"10.1038\/nbt0908-983","volume":"26","author":"Mestres J.","year":"2008","journal-title":"Nat. Biotechnol."},{"key":"ref13\/cit13","doi-asserted-by":"crossref","first-page":"D1100","DOI":"10.1093\/nar\/gkr777","volume":"40","author":"Gaulton A.","year":"2012","journal-title":"Nucleic Acids Res."},{"key":"ref14\/cit14","doi-asserted-by":"crossref","first-page":"D1035","DOI":"10.1093\/nar\/gkq1126","volume":"39","author":"Knox C.","year":"2011","journal-title":"Nucleic Acids Res."},{"key":"ref15\/cit15","doi-asserted-by":"crossref","first-page":"127","DOI":"10.1002\/1097-0282(2002)61:2<127::AID-BIP10076>3.0.CO;2-N","volume":"61","author":"Chen X.","year":"2001","journal-title":"Biopolymers"},{"key":"ref16\/cit16","doi-asserted-by":"crossref","first-page":"130","DOI":"10.1093\/bioinformatics\/18.1.130","volume":"18","author":"Chen X.","year":"2002","journal-title":"Bioinformatics"},{"key":"ref17\/cit17","doi-asserted-by":"crossref","first-page":"719","DOI":"10.2174\/1386207013330670","volume":"4","author":"Chen X.","year":"2001","journal-title":"Comb. Chem. High Throughput Screening"},{"key":"ref18\/cit18","doi-asserted-by":"crossref","first-page":"2977","DOI":"10.1021\/jm030580l","volume":"47","author":"Wang R.","year":"2004","journal-title":"J. Med. Chem."},{"key":"ref19\/cit19","doi-asserted-by":"crossref","first-page":"4111","DOI":"10.1021\/jm048957q","volume":"48","author":"Wang R.","year":"2005","journal-title":"J. Med. Chem."},{"key":"ref20\/cit20","doi-asserted-by":"crossref","first-page":"333","DOI":"10.1002\/prot.20512","volume":"60","author":"Hu L.","year":"2005","journal-title":"Proteins"},{"key":"ref21\/cit21","doi-asserted-by":"crossref","first-page":"414","DOI":"10.1016\/j.jmgm.2005.08.002","volume":"24","author":"Smith R. D.","year":"2006","journal-title":"J. Mol. Graphics Modell."},{"key":"ref22\/cit22","doi-asserted-by":"crossref","first-page":"113","DOI":"10.1007\/s10822-007-9105-3","volume":"21","author":"Oprea T. I.","year":"2007","journal-title":"J. Comput.-Aided Mol. Des."},{"key":"ref23\/cit23","doi-asserted-by":"crossref","first-page":"D907","DOI":"10.1093\/nar\/gkm948","volume":"36","author":"Okuno Y.","year":"2008","journal-title":"Nucleic Acids Res."},{"key":"ref24\/cit24","first-page":"470","volume":"6","author":"Krejsa C. M.","year":"2003","journal-title":"Curr. Opin. Drug Discovery Dev."},{"key":"ref25\/cit25","doi-asserted-by":"crossref","first-page":"719","DOI":"10.2174\/138620707782507313","volume":"10","author":"Bender A.","year":"2007","journal-title":"Comb. Chem. High Throughput Screening"},{"key":"ref26\/cit26","doi-asserted-by":"crossref","first-page":"348","DOI":"10.1021\/ci8003896","volume":"49","author":"van der Horst E.","year":"2009","journal-title":"J. Chem. Inf. Model."},{"key":"ref27\/cit27","doi-asserted-by":"crossref","first-page":"5","DOI":"10.1038\/sj.bjp.0707308","volume":"152","author":"Klabunde T.","year":"2007","journal-title":"Br. J. Pharmacol."},{"key":"ref28\/cit28","doi-asserted-by":"crossref","first-page":"16","DOI":"10.1039\/C0MD00165A","volume":"2","author":"van Westen G. J. P.","year":"2011","journal-title":"Med. Chem. Commun."},{"key":"ref29\/cit29","doi-asserted-by":"crossref","first-page":"205","DOI":"10.1021\/ci900419k","volume":"50","author":"Geppert H.","year":"2010","journal-title":"J. Chem. Inf. Model."},{"key":"ref30\/cit30","doi-asserted-by":"crossref","first-page":"108","DOI":"10.1021\/ci800249s","volume":"49","author":"Bender A.","year":"2009","journal-title":"J. Chem. Inf. Model."},{"key":"ref31\/cit31","doi-asserted-by":"crossref","first-page":"539","DOI":"10.1021\/jm900817u","volume":"53","author":"Leach A. R.","year":"2010","journal-title":"J. Med. Chem."},{"issue":"1","key":"ref32\/cit32","doi-asserted-by":"crossref","first-page":"S7","DOI":"10.1038\/sj.bjp.0707515","volume":"153","author":"Moitessier N.","year":"2008","journal-title":"Br. J. Pharmacol."},{"key":"ref33\/cit33","doi-asserted-by":"crossref","first-page":"28","DOI":"10.1039\/C1MD00210D","volume":"3","author":"Sanders M. P. A.","year":"2011","journal-title":"MedChemComm"},{"key":"ref34\/cit34","doi-asserted-by":"crossref","first-page":"4026","DOI":"10.2174\/138161209789824786","volume":"15","author":"de Graaf C.","year":"2009","journal-title":"Curr. Pharm. Des."},{"key":"ref35\/cit35","doi-asserted-by":"crossref","first-page":"W609","DOI":"10.1093\/nar\/gkq300","volume":"38","author":"Liu X.","year":"2010","journal-title":"Nucleic Acids Res."},{"key":"ref36\/cit36","doi-asserted-by":"crossref","first-page":"579","DOI":"10.1038\/nrd3478","volume":"10","author":"Rask-Andersen M.","year":"2011","journal-title":"Nat. Rev. Drug Discovery"},{"key":"ref37\/cit37","doi-asserted-by":"crossref","first-page":"441","DOI":"10.1517\/17425255.2011.557066","volume":"7","author":"Szabo N.","year":"2011","journal-title":"Expert Opin. Drug Metab. Toxicol."},{"key":"ref38\/cit38","doi-asserted-by":"crossref","first-page":"79","DOI":"10.1038\/nrc2069","volume":"7","author":"Dorsam R. T.","year":"2007","journal-title":"Nat. Rev. Cancer"},{"key":"ref39\/cit39","doi-asserted-by":"crossref","first-page":"1258","DOI":"10.1126\/science.1150577","volume":"318","author":"Cherezov V.","year":"2007","journal-title":"Science"},{"key":"ref40\/cit40","doi-asserted-by":"crossref","first-page":"1211","DOI":"10.1126\/science.1164772","volume":"322","author":"Jaakola V. P.","year":"2008","journal-title":"Science"},{"key":"ref41\/cit41","doi-asserted-by":"crossref","first-page":"851","DOI":"10.1126\/science.1215904","volume":"335","author":"Hanson M. A","year":"2012","journal-title":"Science"},{"key":"ref42\/cit42","doi-asserted-by":"crossref","first-page":"322","DOI":"10.1126\/science.1202793","volume":"332","author":"Xu F.","year":"2011","journal-title":"Science"},{"key":"ref243\/cit243","first-page":"512","volume":"50","author":"Jiang Q.","year":"1996","journal-title":"Mol. Pharmacol."},{"key":"ref244\/cit244","doi-asserted-by":"crossref","first-page":"13987","DOI":"10.1074\/jbc.270.23.13987","volume":"270","author":"Kim J.","year":"1995","journal-title":"J. Biol. Chem."},{"key":"ref245\/cit245","first-page":"683","volume":"49","author":"Kim J.","year":"1996","journal-title":"Mol. Pharmacol."},{"key":"ref43\/cit43","doi-asserted-by":"crossref","first-page":"131","DOI":"10.1002\/med.20048","volume":"26","author":"Moro S.","year":"2006","journal-title":"Med. Res. Rev."},{"key":"ref44\/cit44","doi-asserted-by":"crossref","first-page":"10267","DOI":"10.1016\/S0021-9258(19)81509-0","volume":"263","author":"Strader C. D.","year":"1988","journal-title":"J. Biol. Chem."},{"key":"ref45\/cit45","doi-asserted-by":"crossref","first-page":"4384","DOI":"10.1073\/pnas.84.13.4384","volume":"84","author":"Strader C. D.","year":"1987","journal-title":"Proc. Natl. Acad. Sci. U.S.A."},{"key":"ref249\/cit249","doi-asserted-by":"crossref","first-page":"37779","DOI":"10.1074\/jbc.M002092200","volume":"275","author":"Liapakis G.","year":"2000","journal-title":"J. Biol. Chem."},{"key":"ref250\/cit250","first-page":"111","volume":"44","author":"Suryanarayana S.","year":"1993","journal-title":"Mol. Pharmacol."},{"key":"ref46\/cit46","doi-asserted-by":"crossref","first-page":"13572","DOI":"10.1016\/S0021-9258(18)80035-7","volume":"264","author":"Strader C. D.","year":"1989","journal-title":"J. Biol. Chem."},{"key":"ref47\/cit47","doi-asserted-by":"crossref","first-page":"9276","DOI":"10.1073\/pnas.93.17.9276","volume":"93","author":"Wieland K.","year":"1996","journal-title":"Proc. Natl. Acad. Sci. U.S.A."},{"key":"ref48\/cit48","doi-asserted-by":"crossref","first-page":"128","DOI":"10.1124\/mol.53.1.128","volume":"53","author":"Kikkawa H.","year":"1998","journal-title":"Mol. Pharmacol."},{"key":"ref49\/cit49","doi-asserted-by":"crossref","first-page":"1189","DOI":"10.1016\/j.jmgm.2007.11.001","volume":"26","author":"Pham T. C.","year":"2008","journal-title":"J. Mol. Graphics Modell."},{"key":"ref50\/cit50","doi-asserted-by":"crossref","first-page":"39379","DOI":"10.1074\/jbc.M007680200","volume":"275","author":"Parrill A. L.","year":"2000","journal-title":"J. Biol. Chem."},{"key":"ref51\/cit51","doi-asserted-by":"crossref","first-page":"49213","DOI":"10.1074\/jbc.M107301200","volume":"276","author":"Wang D. A.","year":"2001","journal-title":"J. Biol. Chem."},{"key":"ref52\/cit52","doi-asserted-by":"crossref","first-page":"509","DOI":"10.1002\/prot.20768","volume":"62","author":"Surgand J. S.","year":"2006","journal-title":"Proteins"},{"key":"ref53\/cit53","doi-asserted-by":"crossref","first-page":"105","DOI":"10.1016\/j.ejphar.2011.05.071","volume":"667","author":"van Loenen P. B.","year":"2011","journal-title":"Eur. J. Pharmacol."},{"key":"ref62\/cit62","doi-asserted-by":"crossref","first-page":"2302","DOI":"10.1002\/cmdc.201100369","volume":"6","author":"van der Horst E.","year":"2011","journal-title":"ChemMedChem"},{"key":"ref58\/cit58","doi-asserted-by":"crossref","first-page":"2277","DOI":"10.1021\/ci200088d","volume":"51","author":"Sanders M. P.","year":"2011","journal-title":"J. Chem. Inf. Model."},{"key":"ref54\/cit54","doi-asserted-by":"crossref","first-page":"1395","DOI":"10.1021\/ci100197b","volume":"50","author":"Wawer M.","year":"2010","journal-title":"J. Chem. Inf. Model."},{"key":"ref55\/cit55","doi-asserted-by":"crossref","first-page":"338","DOI":"10.1021\/ci800326z","volume":"49","author":"Steffen A.","year":"2009","journal-title":"J. Chem. Inf. Model."},{"key":"ref263\/cit263","doi-asserted-by":"crossref","first-page":"182","DOI":"10.1016\/j.neulet.2010.06.025","volume":"480","author":"Lee H. G.","year":"2010","journal-title":"Neurosci. Lett."},{"key":"ref264\/cit264","doi-asserted-by":"crossref","first-page":"545","DOI":"10.1016\/j.yjmcc.2007.08.014","volume":"43","author":"Salloum F. N.","year":"2007","journal-title":"J. Mol. Cell. Cardiol."},{"key":"ref56\/cit56","doi-asserted-by":"crossref","first-page":"21469","DOI":"10.1074\/jbc.M512527200","volume":"281","author":"Wang H.","year":"2006","journal-title":"J. Biol. Chem."},{"key":"ref57\/cit57","doi-asserted-by":"crossref","first-page":"508","DOI":"10.1002\/qsar.200430932","volume":"24","author":"Gozalbes R.","year":"2005","journal-title":"QSAR Comb. Sci."},{"key":"ref267\/cit267","doi-asserted-by":"crossref","first-page":"391","DOI":"10.1038\/nrd2541","volume":"7","author":"Goldstein D. M.","year":"2008","journal-title":"Nat. Rev. Drug Discov."},{"key":"ref59\/cit59","doi-asserted-by":"crossref","first-page":"332","DOI":"10.1186\/1471-2105-12-332","volume":"12","author":"Sanders M. P.","year":"2011","journal-title":"BMC Bioinf."},{"key":"ref60\/cit60","doi-asserted-by":"crossref","first-page":"537","DOI":"10.1016\/0898-5529(90)90156-3","volume":"3","author":"Gasteiger J.","year":"1990","journal-title":"Tetrahedron Comput. Methodol."},{"key":"ref61\/cit61","doi-asserted-by":"crossref","first-page":"101","DOI":"10.1186\/1471-2105-10-101","volume":"10","author":"Liu X.","year":"2009","journal-title":"BMC Bioinf."},{"key":"ref63\/cit63","doi-asserted-by":"crossref","first-page":"177","DOI":"10.1021\/ci049714+","volume":"45","author":"Irwin J. J.","year":"2005","journal-title":"J. Chem. Inf. Model."},{"key":"ref64\/cit64","first-page":"647","volume-title":"Proceedings of the 10th ACM SIGKDD International Conference on Knowledge Discovery and Data Mining, 2004","author":"Nijssen S.","year":"2004"},{"key":"ref65\/cit65","doi-asserted-by":"crossref","first-page":"2122","DOI":"10.1039\/c0mb00039f","volume":"6","author":"Del Rio A.","year":"2010","journal-title":"Mol. BioSyst."},{"key":"ref66\/cit66","doi-asserted-by":"crossref","first-page":"3","DOI":"10.1016\/S0169-409X(00)00129-0","volume":"46","author":"Lipinski C. A.","year":"2001","journal-title":"Adv. Drug Delivery Rev."},{"key":"ref67\/cit67","doi-asserted-by":"crossref","first-page":"1250","DOI":"10.1021\/jm021053p","volume":"46","author":"Wenlock M. C.","year":"2003","journal-title":"J. Med. Chem."},{"key":"ref68\/cit68","doi-asserted-by":"crossref","first-page":"544","DOI":"10.1124\/jpet.107.134783","volume":"325","author":"Verzijl D.","year":"2008","journal-title":"J. Pharmacol. Exp. Ther."},{"key":"ref69\/cit69","doi-asserted-by":"crossref","first-page":"986","DOI":"10.1177\/1087057108326144","volume":"13","author":"van der Lee M. M. C.","year":"2008","journal-title":"J. Biomol. Screening"}],"container-title":["Journal of Medicinal Chemistry"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/jm300280e","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2023,4,4]],"date-time":"2023-04-04T00:32:55Z","timestamp":1680568375000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/jm300280e"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2012,5,23]]},"references-count":77,"journal-issue":{"issue":"11","published-print":{"date-parts":[[2012,6,14]]}},"alternative-id":["10.1021\/jm300280e"],"URL":"https:\/\/doi.org\/10.1021\/jm300280e","relation":{},"ISSN":["0022-2623","1520-4804"],"issn-type":[{"value":"0022-2623","type":"print"},{"value":"1520-4804","type":"electronic"}],"subject":[],"published":{"date-parts":[[2012,5,23]]}}}