数据库名称：SuperDRUG2
数据库简述：A one stop resource for approved/marketed drugs.
所属国家/地区：Germany
数据库主要信息：SuperDRUG2 database is a unique, one-stop resource for approved/marketed drugs, containing more than 4,600 active pharmaceutical ingredients. We annotated drugs with regulatory details, chemical structures (2D and 3D), dosage, biological targets, physicochemical properties, external identifiers, side-effects and pharmacokinetic data. Different search mechanisms allow navigation through the chemical space of approved drugs. A 2D chemical structure search is provided in addition to a 3D superposition feature that superposes a drug with ligands already known to be found in the experimentally determined protein-ligand complexes. For the first time, we introduced simulation of “physiologically-based” pharmacokinetics of drugs. Our interaction check feature not only identifies potential drug-drug interactions but also provides alternative recommendations for elderly patients.
建立年份：2005
联系信息：Contact information
University/Institution:
Institute of Biochemistry Charity
Address:
Berlin Center of Genome Based Bioinformatics, 3D Datamining Group, Institute of Biochemistry Charité, Monbijoustrasse 2, 10117 Berlin, Germany
City:
Berlin
Province/State:
Country/Region:
Germany
Contact name (PI/Team):
Robert Preissner
Contact email (PI/Helpdesk):
robert.preissner@charite.de
