Known targets — ChEMBL curated mechanism
ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Acetonitrile. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Acetonitrile SCHEMBL28217639 | 0.84 | — | — | |
| Acetonitrile SCHEMBL27516310 | 0.78 | — | — | |
| Acetonitrile SCHEMBL28029152 | 0.78 | — | — | |
| Acetonitrile SCHEMBL15638047 | 0.78 | — | — | |
| Acetonitrile SCHEMBL10790879 | 0.78 | — | — | |
| Acetonitrile SCHEMBL28253723 | 0.78 | — | — | |
| Acetonitrile SCHEMBL2170891 | 0.78 | — | — | |
| Acetonitrile SCHEMBL3135836 | 0.78 | — | — | |
| Acetonitrile SCHEMBL1330624 | 0.78 | — | — | |
| Acetonitrile SCHEMBL6693864 | 0.78 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116162072-B | Hexafluoropropylene trimer epoxide with specific structure and preparation method thereof | 浙江诺亚氟化工有限公司 | 2024-05-03 | — | — | CN | claimed |
| CN-116162072-A | Hexafluoropropylene trimer epoxide with specific structure and preparation method thereof | 浙江诺亚氟化工有限公司 | 2023-05-26 | — | — | CN | claimed |
| CN-108383933-B | Polytetrafluoroethylene aqueous emulsion, polytetrafluoroethylene fine powder and preparation method | 三明市海斯福化工有限责任公司 | 2020-03-17 | — | — | CN | claimed |
| CN-108383933-A | A kind of aqueous polytetrafluoroethyldispersion lotion, fine polytetrafluoroethylpowder powder and preparation method | 三明市海斯福化工有限责任公司 | 2018-08-10 | — | — | CN | claimed |
| CN-116162072-B | Hexafluoropropylene trimer epoxide with specific structure and preparation method thereof | 浙江诺亚氟化工有限公司 | 2024-05-03 | — | — | CN | disclosed |
| CN-116162072-A | Hexafluoropropylene trimer epoxide with specific structure and preparation method thereof | 浙江诺亚氟化工有限公司 | 2023-05-26 | — | — | CN | disclosed |
| CN-112300577-A | Hot-pressing buffering silicone rubber sheet and manufacturing method thereof | 苏州裕融电子材料有限公司 | 2021-02-02 | — | — | CN | disclosed |
| CN-108383933-B | Polytetrafluoroethylene aqueous emulsion, polytetrafluoroethylene fine powder and preparation method | 三明市海斯福化工有限责任公司 | 2020-03-17 | — | — | CN | disclosed |
| CN-108383933-A | A kind of aqueous polytetrafluoroethyldispersion lotion, fine polytetrafluoroethylpowder powder and preparation method | 三明市海斯福化工有限责任公司 | 2018-08-10 | — | — | CN | disclosed |
| EP-1684682-A2 | REDUCTION OF UNINTENDED USE OF TRANSDERMAL DEVICES | Zars, Inc. (US) | 2006-08-02 | — | — | EP | disclosed |
| WO-2005041883-A2 | REDUCTION OF UNINTENDED USE OF TRANSDERMAL DEVICES | ZARS, INC. (US) | 2005-05-12 | — | — | WO | disclosed |