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 | |
|---|---|---|---|---|
| Water SCHEMBL11675161 | 1.00 | — | — | |
| Water SCHEMBL28173397 | 1.00 | — | — | |
| Water SCHEMBL28119761 | 1.00 | — | — | |
| Water SCHEMBL7449544 | 1.00 | — | — | |
| Water SCHEMBL1032262 | 1.00 | — | — | |
| Water SCHEMBL106634 | 1.00 | — | — | |
| Water SCHEMBL1827142 | 1.00 | — | — | |
| Water SCHEMBL8418993 | 0.82 | — | — | |
| Water SCHEMBL10611907 | 0.82 | — | — | |
| Water SCHEMBL8954903 | 0.82 | — | — |
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 38 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1299500-B1 | METHOD AND APPARATUS FOR DELIVERING A VOLATILE COMPONENT VIA A CONTROLLED EXOTHERMIC REACTION | PROCTER & GAMBLE (US) | 2012-01-18 | — | — | EP | claimed |
| EP-1299499-B1 | METHODS AND REACTION MIXTURES FOR CONTROLLING EXOTHERMIC REACTIONS | PROCTER & GAMBLE (US) | 2006-09-06 | — | — | EP | claimed |
| US-7081211-B2 | Multi-layer reaction mixtures and apparatuses for delivering a volatile component via a controlled exothermic reaction | THE PROCTER & GAMBLE COMPANY (US) | 2006-07-25 | — | — | US | claimed |
| EP-1363678-B1 | COMPOSITION FOR AROMA DELIVERY WITH IMPROVED STABILITY AND REDUCED FOAMING | PROCTER & GAMBLE (US) | 2005-05-18 | — | — | EP | claimed |
| US-20040000660-A1 | Composition for aroma delivery with improved stability and reduced foaming | THE PROCTER & GAMBLE COMPANY | 2004-01-01 | — | — | US | claimed |
| EP-1363678-A1 | COMPOSITION FOR AROMA DELIVERY WITH IMPROVED STABILITY AND REDUCED FOAMING | THE PROCTER & GAMBLE COMPANY (US) | 2003-11-26 | — | — | EP | claimed |
| US-20030101984-A1 | Methods and reaction mixtures for controlling exothermic reactions | THE PROCTER & GAMBLE COMPANY | 2003-06-05 | — | — | US | claimed |
| US-20030105192-A1 | Multi-layer reaction mixtures and apparatuses for delivering a volatile component via a controlled exothermic reaction | THE PROCTER & GAMBLE COMPANY (US) | 2003-06-05 | — | — | US | claimed |
| EP-1299500-A2 | METHODS AND APPARATUSES FOR DELIVERING A VOLATILE COMPONENT VIA A CONTROLLED EXOTHERMIC REACTION | THE PROCTER & GAMBLE COMPANY (US) | 2003-04-09 | — | — | EP | claimed |
| EP-1299499-A1 | METHODS AND REACTION MIXTURES FOR CONTROLLING EXOTHERMIC REACTIONS | THE PROCTER & GAMBLE COMPANY (US) | 2003-04-09 | — | — | EP | claimed |
| EP-1298993-A1 | MULTI-LAYER REACTION MIXTURES AND APPARATUSES FOR DELIVERING A VOLATILE COMPONENT VIA A CONTROLLED EXOTHERMIC REACTION | THE PROCTER & GAMBLE COMPANY (US) | 2003-04-09 | — | — | EP | claimed |
| WO-2002068005-A1 | COMPOSITION FOR AROMA DELIVERY WITH IMPROVED STABILITY AND REDUCED FOAMING | THE PROCTER & GAMBLE COMPANY (US) | 2002-09-06 | — | — | WO | claimed |
| WO-2002005620-A2 | METHODS AND APPARATUSES FOR DELIVERING A VOLATILE COMPONENT VIA A CONTROLLED EXOTHERMIC REACTION | THE PROCTER & GAMBLE COMPANY (US) | 2002-01-24 | — | — | WO | claimed |
| WO-2002005640-A1 | MULTI-LAYER REACTION MIXTURES AND APPARATUSES FOR DELIVERING A VOLATILE COMPONENT VIA A CONTROLLED EXOTHERMIC REACTION | THE PROCTER & GAMBLE COMPANY (US) | 2002-01-24 | — | — | WO | claimed |
| WO-2002006421-A1 | METHODS AND REACTION MIXTURES FOR CONTROLLING EXOTHERMIC REACTIONS | THE PROCTER & GAMBLE COMPANY (US) | 2002-01-24 | — | — | WO | claimed |
| US-4419650-A | Liquid contact relay incorporating gas-containing finely reticular solid motor element for moving conductive liquid | Hirtle, Georgina Chrystall (US) | 1983-12-06 | — | — | US | claimed |
| CN-106654277-A | Application of additive, electrode slurry, additive slurry, cathode or anode of lithium ion battery, preparation method of cathode or anode of lithium ion battery and lithium ion battery | 先雪峰 | 2017-05-10 | — | — | CN | disclosed |
| CN-106410171-A | Lithium ion battery composite active substance and preparation method thereof, lithium ion battery electrode slurry, positive electrode or negative electrode, and lithium ion battery | 先雪峰 | 2017-02-15 | — | — | CN | disclosed |
| US-4583365-A | Reticulated electrothermal fluid motor | Hirtle, Georgina C. (US) | 1986-04-22 | — | — | US | disclosed |
| US-4419650-A | Liquid contact relay incorporating gas-containing finely reticular solid motor element for moving conductive liquid | Hirtle, Georgina Chrystall (US) | 1983-12-06 | — | — | US | disclosed |