Identification of new SUMO activating enzyme 1 inhibitors using virtual screening and scaffold hopping

Bioorganic and Medicinal Chemistry Letters

Volumn 26, Issue 4, 2016, Pages 1218-1223

  Kumar, Ashutosh ^a   Ito, Akihiro ^a,b   Hirohama, Mikako ^a   Yoshida, Minoru ^a,b,c   Zhang, Kam Y J ^a  

^a RIKEN   (Japan)

^b Elements Chemistry Laboratory   (Japan)

^c JAPAN AGENCY FOR MEDICAL RESEARCH AND DEVELOPMENT   (Japan)

Author keywords

Scaffold hopping; SUMO; SUMO E1 inhibitor; Sumoylation; Virtual screening

Indexed keywords

ANTINEOPLASTIC AGENT; GINKGOLIC ACID; NATURAL PRODUCT; PYRAZOLE DERIVATIVE; SUMO ACTIVATING ENZYME 1 INHIBITOR; SUMO E1 PROTEIN; SUMO PROTEIN; THIAZOLE DERIVATIVE; UNCLASSIFIED DRUG; UREA DERIVATIVE; UREA;

CONTROLLED STUDY; CRYSTAL STRUCTURE; DRUG POTENCY; DRUG SCREENING; ENZYME INHIBITION; IC50; MOLECULAR DOCKING; REVIEW; STRUCTURE ACTIVITY RELATION; SUMOYLATION; ANALOGS AND DERIVATIVES; ANTAGONISTS AND INHIBITORS; BINDING SITE; CHEMISTRY; CONFORMATION; HUMAN; METABOLISM; PROTEIN TERTIARY STRUCTURE;

BINDING SITES; HUMANS; INHIBITORY CONCENTRATION 50; MOLECULAR CONFORMATION; MOLECULAR DOCKING SIMULATION; PROTEIN STRUCTURE, TERTIARY; PYRAZOLES; SMALL UBIQUITIN-RELATED MODIFIER PROTEINS; STRUCTURE-ACTIVITY RELATIONSHIP; THIAZOLES; UREA;

EID: 84958115640     PISSN: 0960894X     EISSN: 14643405     Source Type: Journal    
DOI: 10.1016/j.bmcl.2016.01.030     Document Type: Article

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