DrugBank Release Version 5.1.2

These DrugBank datasets are released under a Creative Common's Attribution-NonCommercial 4.0 International License

Released onVersionSizeCommandDownload (XML)Schema Definition
All drugs2018-12-205.1.2125 MBExample
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View

These DrugBank datasets are released under a Creative Common's Attribution-NonCommercial 4.0 International License

Full Drug Structures in SDF Format

Drug groupReleased onVersionSizeCommandDownload (SDF)
All2018-12-205.1.27.26 MBExample
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All (3D)2018-12-205.1.28.82 MBExample
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Approved2018-12-205.1.22.66 MBExample
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Experimental2018-12-205.1.23.33 MBExample
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Nutraceutical2018-12-205.1.2154 KBExample
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Illicit2018-12-205.1.2124 KBExample
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Withdrawn2018-12-205.1.2154 KBExample
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Investigational2018-12-205.1.22.5 MBExample
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Structure External Links

New! The structure external links datasets are CSV files which include structure information in the form of InChI/InChI Key/SMILES as well as identifiers for other drug-structure resources (such as ChEBI, ChEMBL, etc.). Included in each dataset is also the PubChem Compound ID (CID) and the particular PubChem Substance ID (SID) for the given DrugBank record.

Drug groupReleased onVersionSizeCommandDownload (CSV)
All2018-12-205.1.21.32 MBExample
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Approved2018-12-205.1.2344 KBExample
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Experimental2018-12-205.1.2727 KBExample
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Nutraceutical2018-12-205.1.216.5 KBExample
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Illicit2018-12-205.1.222.6 KBExample
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Withdrawn2018-12-205.1.230.5 KBExample
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Investigational2018-12-205.1.2447 KBExample
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Full Metabolite Structures in SDF Format New!

Released onVersionSizeCommandDownload (SDF)
2018-12-205.1.21020 KBExample
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Protein identifiers include external IDs to resources such as UniProt and PDB.These downloads are divided first by protein/compound type (target, transporter, etc.). Secondly they are divided by drug group (approved, illicit, etc.). Each archive contains 2 files: one for all target/enzyme/transporter/carriers and one with only those marked as pharmacologically active (directly related to the mechanism of action for at least one of the associated drugs).

Note that each row in the export CSV file also includes a concatenated list of DrugBank drugs IDs (semi-colon delimited) as the last column.

These DrugBank datasets are released under a Creative Common's Attribution-NonCommercial 4.0 International License

Drug Target Identifiers

Drug groupReleased onVersionSizeCommandDownload (CSV)
All2018-12-205.1.2443 KBExample
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Approved2018-12-205.1.2280 KBExample
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Small Molecule2018-12-205.1.2423 KBExample
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Biotech2018-12-205.1.241.9 KBExample
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Experimental2018-12-205.1.2248 KBExample
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Nutraceutical2018-12-205.1.259.6 KBExample
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Illicit2018-12-205.1.213.2 KBExample
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Withdrawn2018-12-205.1.236.2 KBExample
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Investigational2018-12-205.1.2247 KBExample
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Drug Enzyme Identifiers

Drug groupReleased onVersionSizeCommandDownload (CSV)
All2018-12-205.1.242.2 KBExample
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Approved2018-12-205.1.239.4 KBExample
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Small Molecule2018-12-205.1.239.5 KBExample
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Biotech2018-12-205.1.28.19 KBExample
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Experimental2018-12-205.1.27.62 KBExample
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Nutraceutical2018-12-205.1.27.96 KBExample
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Illicit2018-12-205.1.22.74 KBExample
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Withdrawn2018-12-205.1.24.47 KBExample
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Investigational2018-12-205.1.228.3 KBExample
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Drug Carrier Identifiers

Drug groupReleased onVersionSizeCommandDownload (CSV)
All2018-12-205.1.29.6 KBExample
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Approved2018-12-205.1.29.18 KBExample
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Small Molecule2018-12-205.1.29.46 KBExample
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Biotech2018-12-205.1.2993 BytesExample
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Experimental2018-12-205.1.23.34 KBExample
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Nutraceutical2018-12-205.1.21.65 KBExample
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Illicit2018-12-205.1.22.19 KBExample
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Withdrawn2018-12-205.1.21.19 KBExample
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Investigational2018-12-205.1.25.46 KBExample
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Drug Transporter Identifiers

Drug groupReleased onVersionSizeCommandDownload (CSV)
All2018-12-205.1.215.4 KBExample
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Approved2018-12-205.1.214.4 KBExample
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Small Molecule2018-12-205.1.215.4 KBExample
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Biotech2018-12-205.1.2737 BytesExample
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Experimental2018-12-205.1.23.2 KBExample
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Nutraceutical2018-12-205.1.22.65 KBExample
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Illicit2018-12-205.1.21.28 KBExample
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Withdrawn2018-12-205.1.21.92 KBExample
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Investigational2018-12-205.1.29.81 KBExample
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These DrugBank datasets are released under a Creative Common's Attribution-NonCommercial 4.0 International License

Drug Target Sequences (FASTA Format)

Drug groupReleased onVersionSizeCommandDownload
All2018-12-205.1.24.08 MBExample
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Approved2018-12-205.1.22.6 MBExample
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Small Molecule2018-12-205.1.23.94 MBExample
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Biotech2018-12-205.1.2390 KBExample
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Experimental2018-12-205.1.22.2 MBExample
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Nutraceutical2018-12-205.1.2724 KBExample
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Illicit2018-12-205.1.299.3 KBExample
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Withdrawn2018-12-205.1.2328 KBExample
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Investigational2018-12-205.1.22.35 MBExample
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Drug Enzyme Sequences (FASTA Format)

Drug groupReleased onVersionSizeCommandDownload
All2018-12-205.1.2318 KBExample
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Approved2018-12-205.1.2303 KBExample
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Small Molecule2018-12-205.1.2295 KBExample
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Biotech2018-12-205.1.261.3 KBExample
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Experimental2018-12-205.1.270.5 KBExample
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Nutraceutical2018-12-205.1.2103 KBExample
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Illicit2018-12-205.1.226.6 KBExample
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Withdrawn2018-12-205.1.244 KBExample
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Investigational2018-12-205.1.2227 KBExample
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Drug Carrier Sequences (FASTA Format)

Drug groupReleased onVersionSizeCommandDownload
All2018-12-205.1.261.8 KBExample
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Approved2018-12-205.1.260.7 KBExample
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Small Molecule2018-12-205.1.257.4 KBExample
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Biotech2018-12-205.1.26.32 KBExample
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Experimental2018-12-205.1.211.9 KBExample
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Nutraceutical2018-12-205.1.29.71 KBExample
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Illicit2018-12-205.1.22.79 KBExample
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Withdrawn2018-12-205.1.29.57 KBExample
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Investigational2018-12-205.1.249.1 KBExample
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Drug Transporter Sequences (FASTA Format)

Drug groupReleased onVersionSizeCommandDownload
All2018-12-205.1.2274 KBExample
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Approved2018-12-205.1.2270 KBExample
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Small Molecule2018-12-205.1.2274 KBExample
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Biotech2018-12-205.1.28.63 KBExample
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Experimental2018-12-205.1.259.6 KBExample
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Nutraceutical2018-12-205.1.253.4 KBExample
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Illicit2018-12-205.1.217.3 KBExample
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Withdrawn2018-12-205.1.239.5 KBExample
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Investigational2018-12-205.1.2194 KBExample
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These DrugBank datasets are released under a Creative Common's Attribution-NonCommercial 4.0 International License

Drug groupReleased onVersionSizeCommandDownload (FASTA Format)
All2018-12-205.1.243.4 KBExample
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Approved2018-12-205.1.235.8 KBExample
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Experimental2018-12-205.1.21.84 KBExample
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Nutraceutical2018-12-205.1.2140 BytesExample
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Illicit2018-12-205.1.2140 BytesExample
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Withdrawn2018-12-205.1.23.95 KBExample
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Investigational2018-12-205.1.229 KBExample
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The DrugBank Open Data datasets are public domain datasets that can be used freely in your application or project (including commercial use). It is released under a Creative Common's CC0 International License.
To the extent possible under law, the person who associated CC0 with the DrugBank Open Data has waived all copyright and related or neighboring rights to the DrugBank Open Data. This work is published from: Canada.

DatasetDescriptionReleased onVersionSizeFormatCommandDownload
DrugBank VocabularyDrugBank identifiers, names, and synonyms to permit easy linking and integration into any type of project. 2018-12-205.1.2623 KBCSVExample
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DrugBank StructuresDrugBank structures, names, and synonyms to permit easy linking and integration into any type of project. 2018-12-205.1.23.31 MBSDFExample
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