Known targets — ChEMBL curated mechanism
ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO
The experimentally established mechanism targets of Water. 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 | |
|---|---|---|---|---|
| Lithium Ion SCHEMBL57267 | 0.94 | — | — | |
| Water SCHEMBL3837143 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL29233054 | 0.89 | — | — | |
| Ammonia Solution, Strong SCHEMBL28851759 | 0.89 | — | — | |
| Lithium Ion SCHEMBL18335255 | 0.89 | — | — | |
| Water SCHEMBL8933650 | 0.89 | — | — | |
| SCHEMBL4352440 | 0.88 | — | — | |
| Lithium Ion SCHEMBL29921021 | 0.88 | — | — | |
| Fluoride Ion SCHEMBL665331 | 0.84 | — | — | |
| Fluoride Ion SCHEMBL2475577 | 0.84 | — | — |
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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114381184-A | Bi-component flake graphite epoxy static conductive anticorrosive paint with excellent comprehensive performance and preparation method thereof | 江苏云湖新材料科技有限公司 | 2022-04-22 | — | — | CN | claimed |
| CN-107502034-B | Frictional water-based environment-friendly paint layer cleaning agent and preparation method and application thereof | 广东嘉盛环保高新材料股份有限公司 | 2021-01-19 | — | — | CN | claimed |
| CN-107474625-B | Corrosion-free scratch-free metal paint remover and preparation method and application thereof | 西安汇诚化工科技有限公司 | 2021-01-05 | — | — | CN | claimed |
| CN-107353701-B | Corrosion-free scratch-free metal paint remover and preparation method and application thereof | 山东天智信息科技有限公司 | 2020-12-04 | — | — | CN | claimed |
| CN-107502033-B | Frictional water-based environment-friendly paint layer cleaning agent and preparation method and application thereof | 山东天智信息科技有限公司 | 2020-12-04 | — | — | CN | claimed |
| CN-110894391-A | Long-acting acid and alkali corrosion resistant water-based epoxy anticorrosive paint and preparation method thereof | 无锡市太湖防腐材料有限公司 | 2020-03-20 | — | — | CN | claimed |
| CN-110403043-A | Lotion and chocolate containing the lotion | KERRY SPECIALTY FATS SHANGHAI CO LTD | 2019-11-05 | — | — | CN | claimed |
| CN-107502033-A | A kind of water base environmentally friendly enamelled coating cleaning agent of frictional property and its preparation method and application | 无锡市恒利弘实业有限公司 | 2017-12-22 | — | — | CN | claimed |
| CN-107502034-A | A kind of water base environmentally friendly enamelled coating cleaning agent of frictional property and its preparation method and application | 无锡市恒利弘实业有限公司 | 2017-12-22 | — | — | CN | claimed |
| CN-107474625-A | It is a kind of corrosion-free without scuffing metal paint remover and its preparation method and application | 无锡市恒利弘实业有限公司 | 2017-12-15 | — | — | CN | claimed |
| CN-107353701-A | It is a kind of corrosion-free without scuffing metal paint remover and its preparation method and application | 无锡市恒利弘实业有限公司 | 2017-11-17 | — | — | CN | claimed |
| CN-102746958-B | Matched cleaning agent for vacuum drainage pipelines of airplane toilets and preparation method and cleaning process of matched cleaning agent | BEIJING YADILITE AVIAT CHEMICALS CO LTD | 2015-02-18 | — | — | CN | claimed |
| CN-102746958-A | Matched cleaning agent for vacuum drainage pipelines of airplane toilets and preparation method and cleaning process of matched cleaning agent | BEIJING YADILITE AVIAT CHEMICALS CO LTD | 2012-10-24 | — | — | CN | claimed |
| CN-102206440-A | Environment-friendly paint remover for airplane and preparation method thereof | BEIJING YADILITE AVIAT CHEMICALS CO LTD | 2011-10-05 | — | — | CN | claimed |
| CN-110403043-B | Emulsion and chocolate containing same | 嘉里特种油脂（上海）有限公司 | 2022-07-26 | — | — | CN | disclosed |
| CN-114381184-A | Bi-component flake graphite epoxy static conductive anticorrosive paint with excellent comprehensive performance and preparation method thereof | 江苏云湖新材料科技有限公司 | 2022-04-22 | — | — | CN | disclosed |
| CN-107502034-B | Frictional water-based environment-friendly paint layer cleaning agent and preparation method and application thereof | 广东嘉盛环保高新材料股份有限公司 | 2021-01-19 | — | — | CN | disclosed |
| CN-101668493-A | Oral care compositions, methods, devices and systems | GILLETTE CO | 2010-03-10 | — | — | CN | disclosed |
| CN-101321503-A | Oral care compositions, methods, devices, and systems | GILLETTE CO (US) | 2008-12-10 | — | — | CN | disclosed |
| CN-101060887-A | Oral care compositions | GILLETTE CO (US) | 2007-10-24 | — | — | CN | disclosed |