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 SCHEMBL8716040 | 1.00 | CA1 (0.43) | — | |
| SCHEMBL15068452 | 0.96 | CA1 (0.46) | — | |
| SCHEMBL15584 | 0.96 | — | — | |
| SCHEMBL324713 | 0.92 | — | — | |
| Strontium SCHEMBL10626900 | 0.92 | — | — | |
| SCHEMBL11244035 | 0.92 | — | — | |
| SCHEMBL3265050 | 0.92 | — | — | |
| SCHEMBL6531312 | 0.92 | — | — | |
| SCHEMBL4729227 | 0.92 | — | — | |
| SCHEMBL6537240 | 0.92 | — | — |
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 487 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20240237649-A1 | CRYSTALLINE FORMS OF 5-FLUORO-4-IMINO-3-METHYL-1-TOSYL-3,4-DIHYDROPYRIMIDIN-2-ONE, AND MIXTURES, COMPOSITIONS AND METHODS OF USE THEREOF | ADAMA MAKHTESHIM LTD. (IL) | 2024-07-18 | — | — | US | claimed |
| CN-114787434-B | Method for producing carbon fiber bundle | 帝人株式会社 | 2024-07-12 | — | — | CN | claimed |
| EP-4334291-A1 | CRYSTALLINE FORMS OF 5-FLUORO-4-IMINO-3-METHYL-1-TOSYL-3,4- DIHYDROPYRIMIDIN-2-ONE, AND MIXTURES, COMPOSITIONS AND METHODS OF USE THEREOF | ADAMA MAKHTESHIM LTD. (IL) | 2024-03-13 | — | — | EP | claimed |
| CN-117545743-A | Crystalline forms of 5-fluoro-4-imino-3-methyl-1-tosyl-3, 4-dihydropyrimidin-2-one, and mixtures, compositions, and methods of use thereof | 阿达玛马克西姆股份有限公司 | 2024-02-09 | — | — | CN | claimed |
| US-20230292746-A1 | MIXTURES AND COMPOSITIONS COMPRISING 5-FLUORO-4-IMINO-3- METHYL-1-TOSYL-3,4-DIHYDROPYRIMIDIN-2-ONE, AND METHODS OF USE THEREOF | ADAMA MAKHTESHIM LTD. (IL) | 2023-09-21 | — | — | US | claimed |
| US-11697709-B2 | Poly(arylene ether) compositions and articles incorporating the same | THE BOEING COMPANY (US) | 2023-07-11 | — | — | US | claimed |
| EP-4146632-A1 | MIXTURES AND COMPOSITIONS COMPRISING 5-FLUORO-4-IMINO-3- METHYL-1-TOSYL-3,4-DIHYDROPYRIMIDIN-2-ONE, AND METHODS OF USE THEREOF | Adama Makhteshim Ltd. (IL) | 2023-03-15 | — | — | EP | claimed |
| WO-2022234487-A9 | CRYSTALLINE FORMS OF 5-FLUORO-4-IMINO-3-METHYL-1-TOSYL-3,4- DIHYDROPYRIMIDIN-2-ONE, AND MIXTURES, COMPOSITIONS AND METHODS OF USE THEREOF | ADAMA MAKHTESHIM LTD. (IL) | 2022-12-15 | — | — | WO | claimed |
| WO-2022234487-A1 | CRYSTALLINE FORMS OF 5-FLUORO-4-IMINO-3-METHYL-1-TOSYL-3,4- DIHYDROPYRIMIDIN-2-ONE, AND MIXTURES, COMPOSITIONS AND METHODS OF USE THEREOF | ADAMA MAKHTESHIM LTD. (IL) | 2022-11-10 | — | — | WO | claimed |
| CN-114787434-A | Method for producing carbon fiber bundle | 帝人株式会社 | 2022-07-22 | — | — | CN | claimed |
| EP-1450757-A1 | SHAMPOO CONTAINING AN ALKYL ETHER | The Procter & Gamble Company (US) | 2004-09-01 | — | — | EP | claimed |
| US-20030143399-A1 | Heat-expandable macrosphere and process for producing the same | KUREHA CORPORATION (JP) | 2003-07-31 | — | — | US | claimed |
| US-20030143174-A1 | Shampoo containing an alkyl ether | THE PROCTER & GAMBLE COMPANY | 2003-07-31 | — | — | US | claimed |
| US-20030114546-A1 | Thermally foamable microsphere and production process thereof | KUREHA CORPORATION (JP) | 2003-06-19 | — | — | US | claimed |
| WO-2003047540-A1 | SHAMPOO CONTAINING AN ALKYL ETHER | THE PROCTER & GAMBLE COMPANY (US) | 2003-06-12 | — | — | WO | claimed |
| CN-1409788-A | Sizing composition | AKZO NOBEL NV (NL) | 2003-04-09 | — | — | CN | claimed |
| EP-1288272-A1 | HEAT-EXPANDABLE MACROSPHERE AND PROCESS FOR PRODUCING THE SAME | KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) | 2003-03-05 | — | — | EP | claimed |
| EP-1238158-A1 | SIZING COMPOSITION | Akzo Nobel N.V. (NL) | 2002-09-11 | — | — | EP | claimed |
| US-6444024-B1 | SUBSTANTIALLY WATER FREE DISPERSION OF ANHYDRIDE OR KETENE DIMER SIZING AGENT; EMULSIFIER, SUCH AS METHANOXYPOLYETHYLENE GLYCOL COPOLYMERIZED WITH COPOLYMER OF ALPHA OLEFINS AND UNSATURATED CARBOXYLIC ACID DERIVATIVES; STORAGE STABILITY | AKZO NOBEL NV (NL) | 2002-09-03 | — | — | US | claimed |
| WO-2001044575-A1 | SIZING COMPOSITION | AKZO NOBEL N.V. (NL) | 2001-06-21 | — | — | WO | claimed |