DrugBank Release Version 5.1.6

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

Released onVersionSizeCommandDownload (XML)Schema Definition
All drugs2020-04-235.1.6136 MBExampleView

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)
All2020-04-235.1.68.42 MBExample
All (3D)2020-04-235.1.610.1 MBExample
Approved2020-04-235.1.62.98 MBExample
Experimental2020-04-235.1.63.69 MBExample
Nutraceutical2020-04-235.1.6172 KBExample
Illicit2020-04-235.1.6127 KBExample
Withdrawn2020-04-235.1.6166 KBExample
Investigational2020-04-235.1.63.12 MBExample

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)
All2020-04-235.1.61.49 MBExample
Approved2020-04-235.1.6361 KBExample
Experimental2020-04-235.1.6795 KBExample
Nutraceutical2020-04-235.1.616.4 KBExample
Illicit2020-04-235.1.622.7 KBExample
Withdrawn2020-04-235.1.632.1 KBExample
Investigational2020-04-235.1.6536 KBExample

Full Metabolite Structures in SDF Format New!

Released onVersionSizeCommandDownload (SDF)
2020-04-235.1.61.35 MBExample

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)
All2020-04-235.1.6459 KBExample
Approved2020-04-235.1.6290 KBExample
Small Molecule2020-04-235.1.6436 KBExample
Biotech2020-04-235.1.648.2 KBExample
Experimental2020-04-235.1.6254 KBExample
Nutraceutical2020-04-235.1.660 KBExample
Illicit2020-04-235.1.614 KBExample
Withdrawn2020-04-235.1.637.5 KBExample
Investigational2020-04-235.1.6260 KBExample

Drug Enzyme Identifiers

Drug groupReleased onVersionSizeCommandDownload (CSV)
All2020-04-235.1.653.7 KBExample
Approved2020-04-235.1.650 KBExample
Small Molecule2020-04-235.1.649.8 KBExample
Biotech2020-04-235.1.68.88 KBExample
Experimental2020-04-235.1.69.78 KBExample
Nutraceutical2020-04-235.1.69.62 KBExample
Illicit2020-04-235.1.62.87 KBExample
Withdrawn2020-04-235.1.64.81 KBExample
Investigational2020-04-235.1.635.7 KBExample

Drug Carrier Identifiers

Drug groupReleased onVersionSizeCommandDownload (CSV)
All2020-04-235.1.611.6 KBExample
Approved2020-04-235.1.611.2 KBExample
Small Molecule2020-04-235.1.611.1 KBExample
Biotech2020-04-235.1.62.11 KBExample
Experimental2020-04-235.1.63.5 KBExample
Nutraceutical2020-04-235.1.61.86 KBExample
Illicit2020-04-235.1.62.35 KBExample
Withdrawn2020-04-235.1.61.15 KBExample
Investigational2020-04-235.1.65.88 KBExample

Drug Transporter Identifiers

Drug groupReleased onVersionSizeCommandDownload (CSV)
All2020-04-235.1.619.4 KBExample
Approved2020-04-235.1.618.5 KBExample
Small Molecule2020-04-235.1.619.3 KBExample
Biotech2020-04-235.1.61.28 KBExample
Experimental2020-04-235.1.63.89 KBExample
Nutraceutical2020-04-235.1.63.7 KBExample
Illicit2020-04-235.1.61.21 KBExample
Withdrawn2020-04-235.1.62.06 KBExample
Investigational2020-04-235.1.612.3 KBExample

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

Drug Target Sequences (FASTA Format)

Drug groupReleased onVersionSizeCommandDownload
All2020-04-235.1.64.31 MBExample
Approved2020-04-235.1.62.76 MBExample
Small Molecule2020-04-235.1.64.14 MBExample
Biotech2020-04-235.1.6476 KBExample
Experimental2020-04-235.1.62.32 MBExample
Nutraceutical2020-04-235.1.6781 KBExample
Illicit2020-04-235.1.6114 KBExample
Withdrawn2020-04-235.1.6377 KBExample
Investigational2020-04-235.1.62.55 MBExample

Drug Enzyme Sequences (FASTA Format)

Drug groupReleased onVersionSizeCommandDownload
All2020-04-235.1.6376 KBExample
Approved2020-04-235.1.6358 KBExample
Small Molecule2020-04-235.1.6339 KBExample
Biotech2020-04-235.1.666 KBExample
Experimental2020-04-235.1.668.3 KBExample
Nutraceutical2020-04-235.1.6114 KBExample
Illicit2020-04-235.1.626.5 KBExample
Withdrawn2020-04-235.1.645 KBExample
Investigational2020-04-235.1.6259 KBExample

Drug Carrier Sequences (FASTA Format)

Drug groupReleased onVersionSizeCommandDownload
All2020-04-235.1.674.4 KBExample
Approved2020-04-235.1.673.2 KBExample
Small Molecule2020-04-235.1.666.3 KBExample
Biotech2020-04-235.1.611.1 KBExample
Experimental2020-04-235.1.612.8 KBExample
Nutraceutical2020-04-235.1.612.2 KBExample
Illicit2020-04-235.1.63.69 KBExample
Withdrawn2020-04-235.1.66.14 KBExample
Investigational2020-04-235.1.653.3 KBExample

Drug Transporter Sequences (FASTA Format)

Drug groupReleased onVersionSizeCommandDownload
All2020-04-235.1.6355 KBExample
Approved2020-04-235.1.6352 KBExample
Small Molecule2020-04-235.1.6354 KBExample
Biotech2020-04-235.1.617.8 KBExample
Experimental2020-04-235.1.689 KBExample
Nutraceutical2020-04-235.1.684.9 KBExample
Illicit2020-04-235.1.614.3 KBExample
Withdrawn2020-04-235.1.641.4 KBExample
Investigational2020-04-235.1.6239 KBExample

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

Drug groupReleased onVersionSizeCommandDownload (FASTA Format)
All2020-04-235.1.647 KBExample
Approved2020-04-235.1.638.6 KBExample
Experimental2020-04-235.1.61.9 KBExample
Nutraceutical2020-04-235.1.6140 BytesExample
Illicit2020-04-235.1.6140 BytesExample
Withdrawn2020-04-235.1.64.08 KBExample
Investigational2020-04-235.1.631.8 KBExample

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. 2020-04-235.1.6715 KBCSVExample
Download
DrugBank StructuresDrugBank structures, names, and synonyms to permit easy linking and integration into any type of project. 2020-04-235.1.63.8 MBSDFExample
Download