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** [https://compoundcloud.wikibase.cloud/query/#PREFIX%20wd%3A%20%3Chttps%3A%2F%2Fcompoundcloud.wikibase.cloud%2Fentity%2F%3E%0APREFIX%20wdt%3A%20%3Chttps%3A%2F%2Fcompoundcloud.wikibase.cloud%2Fprop%2Fdirect%2F%3E%0A%0ASELECT%20%3Fcmp%20%3FcmpLabel%20%3FtypeLabel%20%3Fpubchem%20%3Fwikidata%20%3Ftoxbank%0A%20%20%20%20%20%20%20%28GROUP_CONCAT%28DISTINCT%20%3FroleLabel%3B%20separator%3D%22%2C%20%22%29%20AS%20%3Froles%29%0AWHERE%20%7B%0A%20%20%3Fcmp%20wdt%3AP21%20wd%3AQ2059%20%3B%20wdt%3AP1%20%3Ftype%20.%0A%20%20OPTIONAL%20%7B%20%3Fcmp%20wdt%3AP13%20%3Fpubchem%20%7D%0A%20%20OPTIONAL%20%7B%20%3Fcmp%20wdt%3AP4%20%3Ftoxbank%20%7D%0A%20%20OPTIONAL%20%7B%20%3Fcmp%20wdt%3AP5%20%3Fwikidata%20%7D%0A%20%20OPTIONAL%20%7B%20%3Fcmp%20wdt%3AP17%20%3Frole%20.%20%3Frole%20rdfs%3Alabel%20%3FroleLabel%20%7D%0A%20%20SERVICE%20wikibase%3Alabel%20%7B%20bd%3AserviceParam%20wikibase%3Alanguage%20%22%5BAUTO_LANGUAGE%5D%2Cen%22.%20%7D%0A%7D%20GROUP%20BY%20%3FtypeLabel%20%3Fcmp%20%3FcmpLabel%20%3Fpubchem%20%3Fwikidata%20%3Ftoxbank VHP4Safety subset]
** [https://compoundcloud.wikibase.cloud/query/#PREFIX%20wd%3A%20%3Chttps%3A%2F%2Fcompoundcloud.wikibase.cloud%2Fentity%2F%3E%0APREFIX%20wdt%3A%20%3Chttps%3A%2F%2Fcompoundcloud.wikibase.cloud%2Fprop%2Fdirect%2F%3E%0A%0ASELECT%20%3Fcmp%20%3FcmpLabel%20%3FtypeLabel%20%3Fpubchem%20%3Fwikidata%20%3Ftoxbank%0A%20%20%20%20%20%20%20%28GROUP_CONCAT%28DISTINCT%20%3FroleLabel%3B%20separator%3D%22%2C%20%22%29%20AS%20%3Froles%29%0AWHERE%20%7B%0A%20%20%3Fcmp%20wdt%3AP21%20wd%3AQ2059%20%3B%20wdt%3AP1%20%3Ftype%20.%0A%20%20OPTIONAL%20%7B%20%3Fcmp%20wdt%3AP13%20%3Fpubchem%20%7D%0A%20%20OPTIONAL%20%7B%20%3Fcmp%20wdt%3AP4%20%3Ftoxbank%20%7D%0A%20%20OPTIONAL%20%7B%20%3Fcmp%20wdt%3AP5%20%3Fwikidata%20%7D%0A%20%20OPTIONAL%20%7B%20%3Fcmp%20wdt%3AP17%20%3Frole%20.%20%3Frole%20rdfs%3Alabel%20%3FroleLabel%20%7D%0A%20%20SERVICE%20wikibase%3Alabel%20%7B%20bd%3AserviceParam%20wikibase%3Alanguage%20%22%5BAUTO_LANGUAGE%5D%2Cen%22.%20%7D%0A%7D%20GROUP%20BY%20%3FtypeLabel%20%3Fcmp%20%3FcmpLabel%20%3Fpubchem%20%3Fwikidata%20%3Ftoxbank VHP4Safety subset]
** [https://compoundcloud.wikibase.cloud/query/#PREFIX%20wd%3A%20%3Chttps%3A%2F%2Fcompoundcloud.wikibase.cloud%2Fentity%2F%3E%0APREFIX%20wdt%3A%20%3Chttps%3A%2F%2Fcompoundcloud.wikibase.cloud%2Fprop%2Fdirect%2F%3E%0A%0ASELECT%20%3Fcmp%20%3FcmpLabel%20%3Fpubchem%20%3Ftoxbank%0A%20%20%20%20%20%20%20%28GROUP_CONCAT%28DISTINCT%20%3FroleLabel%3B%20separator%3D%22%2C%20%22%29%20AS%20%3Froles%29%0AWHERE%20%7B%0A%20%20%3Fcmp%20wdt%3AP13%20%3Fpubchem%20%3B%20wdt%3AP4%20%3Ftoxbank%20.%0A%20%20OPTIONAL%20%7B%20%3Fcmp%20wdt%3AP17%20%3Frole%20.%20%3Frole%20rdfs%3Alabel%20%3FroleLabel%7D%0A%20%20SERVICE%20wikibase%3Alabel%20%7B%20bd%3AserviceParam%20wikibase%3Alanguage%20%22%5BAUTO_LANGUAGE%5D%2Cen%22.%20%7D%0A%7D%20GROUP%20BY%20%3Fcmp%20%3FcmpLabel%20%3Fpubchem%20%3Ftoxbank ToxBank Wiki subset]
** [https://compoundcloud.wikibase.cloud/query/#PREFIX%20wd%3A%20%3Chttps%3A%2F%2Fcompoundcloud.wikibase.cloud%2Fentity%2F%3E%0APREFIX%20wdt%3A%20%3Chttps%3A%2F%2Fcompoundcloud.wikibase.cloud%2Fprop%2Fdirect%2F%3E%0A%0ASELECT%20%3Fcmp%20%3FcmpLabel%20%3Fpubchem%20%3Ftoxbank%0A%20%20%20%20%20%20%20%28GROUP_CONCAT%28DISTINCT%20%3FroleLabel%3B%20separator%3D%22%2C%20%22%29%20AS%20%3Froles%29%0AWHERE%20%7B%0A%20%20%3Fcmp%20wdt%3AP13%20%3Fpubchem%20%3B%20wdt%3AP4%20%3Ftoxbank%20.%0A%20%20OPTIONAL%20%7B%20%3Fcmp%20wdt%3AP17%20%3Frole%20.%20%3Frole%20rdfs%3Alabel%20%3FroleLabel%7D%0A%20%20SERVICE%20wikibase%3Alabel%20%7B%20bd%3AserviceParam%20wikibase%3Alanguage%20%22%5BAUTO_LANGUAGE%5D%2Cen%22.%20%7D%0A%7D%20GROUP%20BY%20%3Fcmp%20%3FcmpLabel%20%3Fpubchem%20%3Ftoxbank ToxBank Wiki subset]
** [https://compoundcloud.wikibase.cloud/query/sparql?query=PREFIX%20wd%3A%20%3Chttps%3A%2F%2Fcompoundcloud.wikibase.cloud%2Fentity%2F%3E%0APREFIX%20wdt%3A%20%3Chttps%3A%2F%2Fcompoundcloud.wikibase.cloud%2Fprop%2Fdirect%2F%3E%0A%0ASELECT%20%3Fcmp%20%3FcmpLabel%20%3Fpubchem%20%3Faopwiki%0A%20%20%20%20%20%20%20(GROUP_CONCAT(DISTINCT%20%3FroleLabel%3B%20separator%3D%22%2C%20%22)%20AS%20%3Froles)%0AWHERE%20%7B%0A%20%20%3Fcmp%20wdt%3AP13%20%3Fpubchem%20%3B%20wdt%3AP36%20%3Faopwiki%20.%0A%20%20OPTIONAL%20%7B%20%3Fcmp%20wdt%3AP17%20%3Frole%20.%20%3Frole%20rdfs%3Alabel%20%3FroleLabel%7D%0A%20%20SERVICE%20wikibase%3Alabel%20%7B%20bd%3AserviceParam%20wikibase%3Alanguage%20%22%5BAUTO_LANGUAGE%5D%2Cen%22.%20%7D%0A%7D%20GROUP%20BY%20%3Fcmp%20%3FcmpLabel%20%3Fpubchem%20%3Faopwiki AOP-Wiki Stressor subset]
* [https://compoundcloud.wikibase.cloud/query/#PREFIX%20wd%3A%20%3Chttps%3A%2F%2Fcompoundcloud.wikibase.cloud%2Fentity%2F%3E%0APREFIX%20wdt%3A%20%3Chttps%3A%2F%2Fcompoundcloud.wikibase.cloud%2Fprop%2Fdirect%2F%3E%0A%0ASELECT%20%3Fcmp%20%3FcmpLabel%20%3Fxenometabolism%0AWHERE%20%7B%0A%20%20%3Fcmp%20wdt%3AP19%20%3Fxenometabolism%20.%0A%20%20SERVICE%20wikibase%3Alabel%20%7B%20bd%3AserviceParam%20wikibase%3Alanguage%20%22%5BAUTO_LANGUAGE%5D%2Cen%22.%20%7D%0A%7D Compound with known xenobiotic metabolism]
* [https://compoundcloud.wikibase.cloud/query/#PREFIX%20wd%3A%20%3Chttps%3A%2F%2Fcompoundcloud.wikibase.cloud%2Fentity%2F%3E%0APREFIX%20wdt%3A%20%3Chttps%3A%2F%2Fcompoundcloud.wikibase.cloud%2Fprop%2Fdirect%2F%3E%0A%0ASELECT%20%3Fcmp%20%3FcmpLabel%20%3Fxenometabolism%0AWHERE%20%7B%0A%20%20%3Fcmp%20wdt%3AP19%20%3Fxenometabolism%20.%0A%20%20SERVICE%20wikibase%3Alabel%20%7B%20bd%3AserviceParam%20wikibase%3Alanguage%20%22%5BAUTO_LANGUAGE%5D%2Cen%22.%20%7D%0A%7D Compound with known xenobiotic metabolism]
* [https://compoundcloud.wikibase.cloud/query/#PREFIX%20wd%3A%20%3Chttps%3A%2F%2Fcompoundcloud.wikibase.cloud%2Fentity%2F%3E%0APREFIX%20wdt%3A%20%3Chttps%3A%2F%2Fcompoundcloud.wikibase.cloud%2Fprop%2Fdirect%2F%3E%0A%0ASELECT%20%3FcollectionLabel%20%28COUNT%28DISTINCT%20%3Fcompound%29%20AS%20%3Fcount%29%20WHERE%20%7B%0A%20%20VALUES%20%3FcollectionType%20%7B%20wd%3AQ52%20wd%3AQ54%20wd%3AQ55%20%7D%0A%20%20%3Fcollection%20wdt%3AP1%20%3FcollectionType%20.%0A%20%20%3Fcompound%20wdt%3AP21%20%3Fcollection%20.%0A%20%20SERVICE%20wikibase%3Alabel%20%7B%20bd%3AserviceParam%20wikibase%3Alanguage%20%22%5BAUTO_LANGUAGE%5D%2Cen%22.%20%7D%0A%7D%20GROUP%20BY%20%3FcollectionLabel%0A%20%20ORDER%20BY%20DESC%28%3Fcount%29 All compound collections]
* [https://compoundcloud.wikibase.cloud/query/#PREFIX%20wd%3A%20%3Chttps%3A%2F%2Fcompoundcloud.wikibase.cloud%2Fentity%2F%3E%0APREFIX%20wdt%3A%20%3Chttps%3A%2F%2Fcompoundcloud.wikibase.cloud%2Fprop%2Fdirect%2F%3E%0A%0ASELECT%20%3FcollectionLabel%20%28COUNT%28DISTINCT%20%3Fcompound%29%20AS%20%3Fcount%29%20WHERE%20%7B%0A%20%20VALUES%20%3FcollectionType%20%7B%20wd%3AQ52%20wd%3AQ54%20wd%3AQ55%20%7D%0A%20%20%3Fcollection%20wdt%3AP1%20%3FcollectionType%20.%0A%20%20%3Fcompound%20wdt%3AP21%20%3Fcollection%20.%0A%20%20SERVICE%20wikibase%3Alabel%20%7B%20bd%3AserviceParam%20wikibase%3Alanguage%20%22%5BAUTO_LANGUAGE%5D%2Cen%22.%20%7D%0A%7D%20GROUP%20BY%20%3FcollectionLabel%0A%20%20ORDER%20BY%20DESC%28%3Fcount%29 All compound collections]

Revision as of 13:41, 14 April 2024

This Wikibase contains information about toxic, safe, and potentially toxic compounds related to the VHP4Safety project. It aggregated public information about them.

A simpler user interface to browse the content is found at https://kb.cloud.vhp4safety.nl/. Here, you can browse collections and look at the knowledge collected in this wiki about specific compounds.

More details

Every VHP4Safety partner can get access. Email Egon Willighagen at Maastricht University.

Queries

The following links are SPARQL queries, taking advantage of the FAIR-ness of this service:

The making of

This Wikibase is populated with the help from cheminformatics tools like the Chemistry Development Kit, Bacting, and public knowledge bases like Wikidata and PubChem.

Funding

VHP4Safety – the Virtual Human Platform for safety assessment project NWA 1292.19.272 is part of the NWA research program ‘Research along Routes by Consortia (ORC)’, which is funded by the Netherlands Organization for Scientific Research (NWO). The project started on June 1, 2021 with a budget of over 10 million Euros and will last for the duration of 5 years.