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  base_id_url: https://www.ebi.ac.uk/chembldb/compound/inspect/
  base_id_url_available: 1
  description: A database of bioactive drug-like small molecules and bioactivities abstracted from the scientific literature.
  name: chembl
  name_label: ChEMBL
  name_long: ChEMBL
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  src_id: 1
  src_url: https://www.ebi.ac.uk/chembl/
  aux_for_url: 0
  base_id_url: http://www.drugbank.ca/drugs/
  base_id_url_available: 1
  description: A database that combines drug (i.e. chemical, pharmacological and pharmaceutical) data with drug target (i.e. sequence, structure, and pathway) information.
  name: drugbank
  name_label: DrugBank
  name_long: DrugBank
    - DB01157
  src_id: 2
  src_url: http://drugbank.ca/
  aux_for_url: 0
  base_id_url: http://www.guidetopharmacology.org/GRAC/LigandDisplayForward?ligandId=
  base_id_url_available: 1
  description: The IUPHAR (International Union of Basic and Clinical Pharmacology)/BPS (British Pharmacological Society) Guide to PHARMACOLOGY database contains structures of small molecule ligands, peptides and antibodies, with their affinities at protein targets.
  name: gtopdb
  name_label: Guide to Pharmacology
  name_long: Guide to Pharmacology
    - 7613
  src_id: 4
  src_url: http://www.guidetopharmacology.org
  aux_for_url: 0
  base_id_url: http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=
  base_id_url_available: 1
  description: "A subset of the PubChem DB: from the original depositor 'drugs of the future' (Prous)."
  name: pubchem_dotf
  name_label: "PubChem: Drugs of the Future "
  name_long: PubChem ('Drugs of the Future' subset)
    - 12012739
  src_id: 5
  src_url: http://pubchem.ncbi.nlm.nih.gov/sources/
  aux_for_url: 0
  base_id_url: http://www.genome.jp/dbget-bin/www_bget?
  base_id_url_available: 1
  description: KEGG LIGAND is a composite DB consisting of COMPOUND, GLYCAN, REACTION, RPAIR, RCLASS, and ENZYME DBs, whose entries are identified by C, G, R, RP, RC, and EC numbers, respectively.
  name: kegg_ligand
  name_label: KEGG Ligand
  name_long: KEGG (Kyoto Encyclopedia of Genes and Genomes) Ligand
    - C11154
  src_id: 6
  src_url: http://www.genome.jp/kegg/ligand.html
  aux_for_url: 0
  base_id_url: http://www-935.ibm.com/services/us/gbs/bao/siip/nih/?sid=
  base_id_url_available: 1
  description: The data are provided by IBM-NIH and include all chemistry extracted by means of text and image mining from the patent corpus (USPTO, WIPO and EPO) for patent documents published through 31-12-2010. Identifiers in UniChem are IBM compound identifiers.
  name: ibm
  name_label: IBM Patent System
  name_long: IBM strategic IP insight platform and the National Institutes of Health
    - 53221324344C6AEED8B40C70702CADEF
  src_id: 11
  src_url: http://www-935.ibm.com/services/us/gbs/bao/siip/nih/
  aux_for_url: 0
  base_id_url: http://worldwide.espacenet.com/searchResults?DB=EPODOC&locale=en_EP&ST=advanced&compact=false&PN=
  base_id_url_available: 1
  description: "The data are provided by IBM-NIH and include exact compounds extracted by means of text and image mining from the patent corpus (USPTO, WIPO and EPO) for patent documents published through 31-12-2010. Further filters included removal of: 1. All molecules mapping to > 10,000 patents, 2. Non-organic molecules, 3. Very small molecules (MW < 90, number of atoms < 7). In addition, for structures mapping to > 100 patents, only 100 randomly selected patent identifiers were included. Identifiers in UniChem are patent number identifiers."
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  name_label: IBM Patents
  name_long: IBM strategic IP insight platform and the National Institutes of Health, Patents
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    - WO2003106646A2
    - US20100216768
    - US20040077568
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    - WO2002009769A2
    - EP1087770A1
    - WO2010078514A2
    - US20040029273
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    - WO2007002905A1
    - US20050245462
    - EP1963502A2
    - US20040102395
    - US20090170799
    - EP1766052A1
    - US20040092573
    - WO2006119643A1
    - US20090304578
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    - US20030096852
    - WO2003000656A2
    - EP1871383A2
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    - US20030087840
    - US20070149615
    - WO2005007825A2
    - US20040157786
    - US20060063935
    - EP0833826B1
    - US20100216820
    - US20080050377
    - EP1104759B1
    - US20060030547
    - WO2009065547A2
    - US6608096
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    - US20060234239
    - US5326764
    - US20060154863
    - EP1920066A1
    - WO2009055074A2
    - US7846691
    - US20030068307
    - US20040102621
    - US20100279291
    - US20100196362
    - US20070259830
    - US20060216265
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    - US7786270
    - EP1973530A2
    - US6566385
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    - WO2008079849A2
    - US20080146652
    - US20100255013
    - US7799899
    - US7775469
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    - EP1309589B1
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    - EP1981341A2
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    - WO2010055525A1
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    - EP1987060A2
    - WO2007089367A2
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    - EP2034996A2
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    - WO2003040172A2
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    - EP1651599A1
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    - WO2000074667A2
    - EP2038262A2
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  src_url: http://www-935.ibm.com/services/us/gbs/bao/siip/nih/
  aux_for_url: 0
  base_id_url: http://fdasis.nlm.nih.gov/srs/ProxyServlet?mergeData=true&objectHandle=DBMaint&APPLICATION_NAME=fdasrs&actionHandle=default&nextPage=jsp/srs/ResultScreen.jsp&TXTSUPERLISTID=
  base_id_url_available: 1
  description: "The primary goal of the FDA/USP Substance Registration System (SRS) is to unambiguously define all substances present in regulated products. Once a substance has been defined, the SRS assigns a strong identifier that is permanently associated with the substance: a UNII (Unique Ingredient Identifier). This is a a non-proprietary, free, unique, unambiguous, nonsemantic, alphanumeric identifier based on a substances molecular structure and/or descriptive information."
  name: fdasrs
  name_label: FDA SRS
  name_long: FDA/USP Substance Registration System (SRS)
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  src_id: 14
  src_url: http://fdasis.nlm.nih.gov/srs/srs.jsp
  aux_for_url: 0
  base_id_url: https://www.surechembl.org/chemical/
  base_id_url_available: 1
  description: SureChEMBL automatically extracts chemistry from the full text of all major patent authorities. Compounds are derived from either chemical names found in text or in chemical depictions. All SureChEMBL compounds are included, except those failing UniChem loading rules.
  name: surechembl
  name_label: SureChEMBL
  name_long: SureChEMBL
    - SCHEMBL3983
  src_id: 15
  src_url: https://www.surechembl.org
  aux_for_url: 0
  base_id_url: http://www.pharmgkb.org/drug/
  base_id_url_available: 1
  description: PharmGKB (Pharmacogenomics Knowledgebase) is a comprehensive resource that curates knowledge about the impact of genetic variation on drug response for clinicians and researchers.
  name: pharmgkb
  name_label: PharmGKB
  name_long: PharmGKB
    - PA451790
  src_id: 17
  src_url: http://www.pharmgkb.org
  aux_for_url: 0
  base_id_url: http://www.hmdb.ca/metabolites/
  base_id_url_available: 1
  description: "The Human Metabolome Database (HMDB) is a freely available electronic database containing detailed information about small molecule metabolites found in the human body. It is intended to be used for applications in metabolomics, clinical chemistry, biomarker discovery and general education. The database is designed to contain or link three kinds of data: 1) chemical data, 2) clinical data, and 3) molecular biology/biochemistry data"
  name: hmdb
  name_label: Human Metabolome Database
  name_long: Human Metabolome Database (HMDB)
    - HMDB15288
  src_id: 18
  src_url: http://www.hmdb.ca
  aux_for_url: 0
  base_id_url: http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=
  base_id_url_available: 1
  description: "A subset of the PubChem DB: from the original depositor 'Thomson Pharma'."
  name: pubchem_tpharma
  name_label: "PubChem: Thomson Pharma "
  name_long: PubChem ('Thomson Pharma' subset)
    - 14803927
  src_id: 21
  src_url: http://www.thomson-pharma.com/
  aux_for_url: 0
  base_id_url: http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=
  base_id_url_available: 1
  description: A database of normalized PubChem compounds (CIDs) from the PubChem Database.
  name: pubchem
  name_label: PubChem
  name_long: PubChem Compounds
    - 5583
  src_id: 22
  src_url: http://pubchem.ncbi.nlm.nih.gov
  aux_for_url: 0
  base_id_url: http://actor.epa.gov/actor/GenericChemical?casrn=
  base_id_url_available: 1
  description: ACToR (Aggregated Computational Toxicology Resource)
  name: actor
  name_label: ACToR
  name_long: ACToR
    - 52128-35-5
  src_id: 26
  src_url: http://actor.epa.gov/actor/faces/ACToRHome.jsp
  aux_for_url: 0
  base_id_url: http://nikkajiweb.jst.go.jp/nikkaji_web/pages/top_e.jsp?CONTENT=syosai&SN=
  base_id_url_available: 1
  description: " Nakkaji (The Japan Chemical Substance Dictionary) is an organic compound dictionary database prepared by the Japan Science and Technology Agency (JST)."
  name: nikkaji
  name_label: Nikkaji
  name_long: Nikkaji
    - J22.060D
  src_id: 29
  src_url: " http://nikkajiweb.jst.go.jp/nikkaji_web/pages/top_e.jsp"
  aux_for_url: 0
  base_id_url: http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=
  base_id_url_available: 1
  description: A public, web-accessible database of measured binding affinities, focusing chiefly on the interactions of protein considered to be drug-targets with small, drug-like molecules
  name: bindingdb
  name_label: BindinDB
  name_long: BindinDB
    - 18268
  src_id: 31
  src_url: ~