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A database designed to assist users find commercial sources of compounds. Access requires (free) registration. Only stock compounds included from Nov 2017.", "name_long": "MolPort", "src_compound_id": ["MolPort-001-780-172"], "base_id_url": "https://www.molport.com/shop/molecule-link/", "src_id": 28, "aux_for_url": false, "base_id_url_available": true, "name_label": "MolPort", "src_url": "https://www.molport.com/shop/molecule-link/MolPort-001-780-172"}, {"name": "chemicalbook", "description": "An online knowledge-base of chemicals and a platform of the Chinese domestic vendors in chemical industry", "name_long": "ChemicalBook", "src_compound_id": ["CB0152851"], "base_id_url": "https://www.chemicalbook.com/ChemicalProductProperty_EN_", "src_id": 39, "aux_for_url": false, "base_id_url_available": true, "name_label": "ChemicalBook", "src_url": "https://www.chemicalbook.com/ChemicalProductProperty_EN_CB0152851"}, {"name": "dailymed_old", "description": "A database of marketed drugs in the USA, containing label and package insert information", "name_long": "DailyMed", "src_compound_id": ["dapsone"], "base_id_url": "https://dailymed.nlm.nih.gov/dailymed/search.cfm?adv=1&labeltype=human&query=INGREDIENT:", "src_id": 40, "aux_for_url": false, "base_id_url_available": true, "name_label": "DailyMed", "src_url": "https://dailymed.nlm.nih.gov/dailymed/search.cfm?adv=1&labeltype=human&query=INGREDIENT:dapsone"}, {"name": "pubchem", "description": "A database of normalized PubChem compounds (CIDs) from the PubChem Database.", "name_long": "PubChem Compounds", "src_compound_id": ["2955"], "base_id_url": "http://pubchem.ncbi.nlm.nih.gov/compound/", "src_id": 22, "aux_for_url": false, "base_id_url_available": true, "name_label": "PubChem", "src_url": "http://pubchem.ncbi.nlm.nih.gov/compound/2955"}, {"name": "probes_and_drugs", "description": "Data from the Probes and Drugs group at probes-drugs.org", "name_long": "Probes And Drugs", "src_compound_id": ["PD002394"], "base_id_url": "https://www.probes-drugs.org/compound/", "src_id": 49, "aux_for_url": false, "base_id_url_available": true, "name_label": "ProbesDrugs", "src_url": "https://www.probes-drugs.org/compound/PD002394"}, {"name": "fdasrs", "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_long": "FDA/USP Substance Registration System (SRS)", "src_compound_id": ["8W5C518302"], "base_id_url": "https://precision.fda.gov/uniisearch/srs/unii/", "src_id": 14, "aux_for_url": false, "base_id_url_available": true, "name_label": "FDA SRS", "src_url": "https://precision.fda.gov/uniisearch/srs/unii/8W5C518302"}, {"name": "pubchem_tpharma", "description": "A subset of the PubChem DB: from the original depositor 'Thomson Pharma'.", "name_long": "PubChem ('Thomson Pharma' subset)", "src_compound_id": ["15196656"], "base_id_url": "http://pubchem.ncbi.nlm.nih.gov/substance/", "src_id": 21, "aux_for_url": false, "base_id_url_available": true, "name_label": "PubChem: Thomson Pharma ", "src_url": "http://pubchem.ncbi.nlm.nih.gov/substance/15196656"}, {"name": "actor", "description": "ACToR (Aggregated Computational Toxicology Resource)", "name_long": "ACToR", "src_compound_id": ["80-08-0"], "base_id_url": "http://actor.epa.gov/actor/chemical.xhtml?casrn=", "src_id": 26, "aux_for_url": false, "base_id_url_available": true, "name_label": "ACToR", "src_url": "http://actor.epa.gov/actor/chemical.xhtml?casrn=80-08-0"}, {"name": "surechembl", "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_long": "SureChEMBL", "src_compound_id": ["SCHEMBL21428"], "base_id_url": "https://www.surechembl.org/chemical/", "src_id": 15, "aux_for_url": false, "base_id_url_available": true, "name_label": "SureChEMBL", "src_url": "https://www.surechembl.org/chemical/SCHEMBL21428"}, {"name": "pharmgkb", "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_long": "PharmGKB", "src_compound_id": ["PA449211"], "base_id_url": "https://www.pharmgkb.org/drug/", "src_id": 17, "aux_for_url": false, "base_id_url_available": true, "name_label": "PharmGKB", "src_url": "https://www.pharmgkb.org/drug/PA449211"}, {"name": "lincs", "description": "The LINCS DCIC facilitates and standardized the information relevant to LINCS assays as described in http://www.lincsproject.org/data/data-standards/", "name_long": "Library of Integrated Network-based Cellular Signatures", "src_compound_id": ["LSM-5714"], "base_id_url": "http://identifiers.org/lincs.smallmolecule/", "src_id": 25, "aux_for_url": false, "base_id_url_available": true, "name_label": "LINCS", "src_url": "http://identifiers.org/lincs.smallmolecule/LSM-5714"}, {"name": "drugbank", "description": "A database that combines drug (i.e. chemical, pharmacological and pharmaceutical) data with drug target (i.e. sequence, structure, and pathway) information.", "name_long": "DrugBank", "src_compound_id": ["DB00250"], "base_id_url": "http://www.drugbank.ca/drugs/", "src_id": 2, "aux_for_url": false, "base_id_url_available": true, "name_label": "DrugBank", "src_url": "http://www.drugbank.ca/drugs/DB00250"}, {"name": "pubchem_dotf", "description": "A subset of the PubChem DB: from the original depositor 'drugs of the future' (Prous).", "name_long": "PubChem ('Drugs of the Future' subset)", "src_compound_id": ["24714727"], "base_id_url": "http://pubchem.ncbi.nlm.nih.gov/substance/", "src_id": 5, "aux_for_url": false, "base_id_url_available": true, "name_label": "PubChem: Drugs of the Future ", "src_url": "http://pubchem.ncbi.nlm.nih.gov/substance/24714727"}, {"name": "chembl", "description": "A database of bioactive drug-like small molecules and bioactivities abstracted from the scientific literature.", "name_long": "ChEMBL", "src_compound_id": ["CHEMBL1043"], "base_id_url": "https://www.ebi.ac.uk/chembldb/compound/inspect/", "src_id": 1, "aux_for_url": false, "base_id_url_available": true, "name_label": "ChEMBL", "src_url": "https://www.ebi.ac.uk/chembldb/compound/inspect/CHEMBL1043"}, {"name": "nih_ncc", "description": "Collections of plated arrays of small molecules that have a history of use in human clinical trials. Assembled by the National Institutes of Health (NIH) through the Molecular Libraries Roadmap Initiative", "name_long": "NIH Clinical Collection", "src_compound_id": ["SAM002554879"], "base_id_url": "", "src_id": 8, "aux_for_url": false, "base_id_url_available": false, "name_label": "NIH Clinical Collection", "src_url": "SAM002554879"}, {"name": "chebi", "description": "ChEBI is a freely available dictionary of molecular entities focused on 'small' chemical compounds", "name_long": "ChEBI (Chemical Entities of Biological Interest).", "src_compound_id": ["4325"], "base_id_url": "http://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI%3A", "src_id": 7, "aux_for_url": false, "base_id_url_available": true, "name_label": "ChEBI", "src_url": "http://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI%3A4325"}, {"name": "kegg_ligand", "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_long": "KEGG (Kyoto Encyclopedia of Genes and Genomes) Ligand", "src_compound_id": ["C07666"], "base_id_url": "http://www.genome.jp/dbget-bin/www_bget?", "src_id": 6, "aux_for_url": false, "base_id_url_available": true, "name_label": "KEGG Ligand", "src_url": "http://www.genome.jp/dbget-bin/www_bget?C07666"}, {"name": "emolecules", "description": "A free chemical structure search engine containing millions of public domain structures. Pricing, availabilities, and vendor information requires an eMolecules Plus subscription.", "name_long": "eMolecules", "src_compound_id": ["498059"], "base_id_url": "https://www.emolecules.com/cgi-bin/more?vid=", "src_id": 10, "aux_for_url": false, "base_id_url_available": true, "name_label": "eMolecules", "src_url": "https://www.emolecules.com/cgi-bin/more?vid=498059"}, {"name": "emolecules", "description": "A free chemical structure search engine containing millions of public domain structures. Pricing, availabilities, and vendor information requires an eMolecules Plus subscription.", "name_long": "eMolecules", "src_compound_id": ["17392619"], "base_id_url": "https://www.emolecules.com/cgi-bin/more?vid=", "src_id": 10, "aux_for_url": false, "base_id_url_available": true, "name_label": "eMolecules", "src_url": "https://www.emolecules.com/cgi-bin/more?vid=17392619"}, {"name": "gtopdb", "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_long": "Guide to Pharmacology", "src_compound_id": ["10934"], "base_id_url": "http://www.guidetopharmacology.org/GRAC/LigandDisplayForward?ligandId=", "src_id": 4, "aux_for_url": false, "base_id_url_available": true, "name_label": "Guide to Pharmacology", "src_url": "http://www.guidetopharmacology.org/GRAC/LigandDisplayForward?ligandId=10934"}, {"name": "dailymed", "description": "A database of marketed drugs in the USA, containing label and package insert information", "name_long": "DailyMed", "src_compound_id": ["DAPSONE"], "base_id_url": "https://dailymed.nlm.nih.gov/dailymed/search.cfm?adv=1&labeltype=human&query=ACTIVEMOIETY:(", "src_id": 45, "aux_for_url": true, "base_id_url_available": true, "name_label": "DailyMed", "src_url": "https://dailymed.nlm.nih.gov/dailymed/search.cfm?adv=1&labeltype=human&query=ACTIVEMOIETY:(DAPSONE)+OR+INGREDIENT:(DAPSONE)"}, {"name": "rxnorm", "description": "RxNorm provides normalized names for clinical drugs and links its names to many of the drug vocabularies commonly used in pharmacy management and drug interaction software", "name_long": "rxnorm", "src_compound_id": ["ACZONE"], "base_id_url": "https://mor.nlm.nih.gov/RxNav/search?searchBy=RXCUI&searchTerm=", "src_id": 47, "aux_for_url": true, "base_id_url_available": true, "name_label": "rxnorm", "src_url": "https://mor.nlm.nih.gov/RxNav/search?searchBy=RXCUI&searchTerm=605173"}, {"name": "rxnorm", "description": "RxNorm provides normalized names for clinical drugs and links its names to many of the drug vocabularies commonly used in pharmacy management and drug interaction software", "name_long": "rxnorm", "src_compound_id": ["DAPSONE"], "base_id_url": "https://mor.nlm.nih.gov/RxNav/search?searchBy=RXCUI&searchTerm=", "src_id": 47, "aux_for_url": true, "base_id_url_available": true, "name_label": "rxnorm", "src_url": "https://mor.nlm.nih.gov/RxNav/search?searchBy=RXCUI&searchTerm=3108"}, {"name": "clinicaltrials", "description": "Intervention names from ClinicalTrials.gov. A database of privately and publicly funded clinical studies conducted around the world", "name_long": "clinicaltrials", "src_compound_id": ["DIAPHENYLSULFONE"], "base_id_url": "https://www.clinicaltrials.gov/ct2/results?cond=&term=", "src_id": 46, "aux_for_url": false, "base_id_url_available": true, "name_label": "clinicaltrials", "src_url": "https://www.clinicaltrials.gov/ct2/results?cond=&term=DIAPHENYLSULFONE"}, {"name": "zinc", "description": "A free database of commercially-available compounds for virtual screening, provided by the Shoichet Laboratory in the Department of Pharmaceutical Chemistry at the University of California, San Francisco (UCSF).  [Irwin and Shoichet, J. Chem. Inf. Model. 2005;45(1):177-82]", "name_long": "ZINC", "src_compound_id": ["ZINC000000006310"], "base_id_url": "http://zinc15.docking.org/substances/", "src_id": 9, "aux_for_url": false, "base_id_url_available": true, "name_label": "ZINC", "src_url": "http://zinc15.docking.org/substances/ZINC000000006310"}, {"name": "clinicaltrials", "description": "Intervention names from ClinicalTrials.gov. A database of privately and publicly funded clinical studies conducted around the world", "name_long": "clinicaltrials", "src_compound_id": ["DAPSONE"], "base_id_url": "https://www.clinicaltrials.gov/ct2/results?cond=&term=", "src_id": 46, "aux_for_url": false, "base_id_url_available": true, "name_label": "clinicaltrials", "src_url": "https://www.clinicaltrials.gov/ct2/results?cond=&term=DAPSONE"}, {"name": "MedChemExpress", "description": "MedChemExpress is a chemical supplier that provides 15,000+ selective Inhibitors and Agonists.", "name_long": "MedChemExpress", "src_compound_id": ["HY-B0688"], "base_id_url": "https://www.medchemexpress.com/", "src_id": 48, "aux_for_url": false, "base_id_url_available": true, "name_label": "MedChemExpress", "src_url": "https://www.medchemexpress.com/HY-B0688"}, {"name": "comptox", "description": "The foundation of chemical safety testing relies on chemistry information such as high-quality chemical structures and physicochemical properties. This information is used by scientists to predict the potential health risks of chemicals.The CompTox Dashboard is part of a suite of dashboards developed by EPA to help evaluate the safety of chemicals. It provides access to a variety of data and information on over 700,000 chemicals currently in use and of interest to environmental researchers. Within the CompTox Dashboard, users can access chemical structures, experimental and predicted physicochemical and toxicity data, and additional links to relevant websites and applications. It maps curated physicochemical property data associated with chemical substances to their corresponding chemical structures", "name_long": "EPA (Environmental Protection Agency) CompTox Dashboard", "src_compound_id": ["DTXSID4020371"], "base_id_url": "https://comptox.epa.gov/dashboard/", "src_id": 32, "aux_for_url": false, "base_id_url_available": true, "name_label": "EPA CompTox Dashboard", "src_url": "https://comptox.epa.gov/dashboard/DTXSID4020371"}, {"name": "drugcentral", "description": "DrugCentral is an online drug information resource created and maintained by Division of Translational Informatics at University of New Mexico, providing information on active ingredients chemical entities, pharmaceutical products, drug mode of action, indications, pharmacologic action", "name_long": "DrugCentral", "src_compound_id": ["782"], "base_id_url": "http://drugcentral.org/drugcard/", "src_id": 34, "aux_for_url": false, "base_id_url_available": true, "name_label": "DrugCentral", "src_url": "http://drugcentral.org/drugcard/782"}, {"name": "clinicaltrials", "description": "Intervention names from ClinicalTrials.gov. A database of privately and publicly funded clinical studies conducted around the world", "name_long": "clinicaltrials", "src_compound_id": ["ACZONE"], "base_id_url": "https://www.clinicaltrials.gov/ct2/results?cond=&term=", "src_id": 46, "aux_for_url": false, "base_id_url_available": true, "name_label": "clinicaltrials", "src_url": "https://www.clinicaltrials.gov/ct2/results?cond=&term=ACZONE"}, {"name": "mcule", "description": "An online drug discovery platform with virtual screening and molecular modelling services.", "name_long": "Mcule", "src_compound_id": ["MCULE-7294380437"], "base_id_url": "https://mcule.com/", "src_id": 23, "aux_for_url": false, "base_id_url_available": true, "name_label": "Mcule", "src_url": "https://mcule.com/MCULE-7294380437"}, {"name": "bindingdb", "description": "A public, web-accessible database of measured binding affinities, focusing chiefly on the interactions of proteins considered to be drug-targets with small, drug-like molecules", "name_long": "BindingDB", "src_compound_id": ["50029764"], "base_id_url": "http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=", "src_id": 31, "aux_for_url": false, "base_id_url_available": true, "name_label": "BindingDB", "src_url": "http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50029764"}, {"name": "nikkaji", "description": " Nakkaji (The Japan Chemical Substance Dictionary) is an organic compound dictionary database prepared by the Japan Science and Technology Agency (JST).", "name_long": "Nikkaji", "src_compound_id": ["J4.247A"], "base_id_url": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=", "src_id": 29, "aux_for_url": false, "base_id_url_available": true, "name_label": "Nikkaji", "src_url": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J4.247A"}]