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 SCHEMBL2836995 | 1.00 | — | — | |
| Water SCHEMBL15577110 | 1.00 | — | — | |
| Water SCHEMBL7626051 | 1.00 | — | — | |
| Water SCHEMBL9559511 | 1.00 | — | — | |
| Water SCHEMBL11655347 | 1.00 | — | — | |
| Water SCHEMBL1711800 | 1.00 | — | — | |
| Water SCHEMBL8069385 | 1.00 | — | — | |
| Water SCHEMBL18044802 | 1.00 | — | — | |
| Water SCHEMBL26332 | 1.00 | — | — | |
| Water SCHEMBL3744115 | 1.00 | — | — |
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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114040534-A | Non-cracking copper-based heterogeneous layered electrode structure and preparation method thereof | 浙江大学 | 2022-02-11 | — | — | CN | claimed |
| CN-108220755-A | A kind of method for preparing zirconium oxide-zirconium carbide particle enhancing gray cast iron | 山东建筑大学 | 2018-06-29 | — | — | CN | claimed |
| CN-104829227-B | A kind of zirconium oxide zirconium boride two-layer compound ceramic heating element and preparation method thereof | 河南科技大学 | 2017-03-01 | — | — | CN | claimed |
| CN-104844199-B | Technology for preparing zirconia-zirconium boride bilayer composite ceramic heating unit through slip casting method | 河南科技大学 | 2017-01-11 | — | — | CN | claimed |
| CN-111018521-B | Zirconia-zirconium boride composite ceramic and preparation method and application thereof | 广东工业大学 | 2022-03-25 | — | — | CN | disclosed |
| CN-114040534-A | Non-cracking copper-based heterogeneous layered electrode structure and preparation method thereof | 浙江大学 | 2022-02-11 | — | — | CN | disclosed |
| CN-114040534-A | Non-cracking copper-based heterogeneous layered electrode structure and preparation method thereof | 浙江大学 | 2022-02-11 | — | — | CN | disclosed |
| EP-3909928-A1 | WAVEGUIDE WITH OUTER COATING FOR ANALYTE DETECTION | Nederlandse Organisatie voor toegepast- natuurwetenschappelijk Onderzoek TNO (NL) | 2021-11-17 | — | — | EP | disclosed |
| CN-111470870-B | Composite ceramic microsphere and preparation method thereof | 清华大学 | 2021-06-22 | — | — | CN | disclosed |
| CN-111470870-A | Composite ceramic microsphere and preparation method thereof | 清华大学 | 2020-07-31 | — | — | CN | disclosed |
| CN-111018521-A | Zirconia-zirconium boride composite ceramic and preparation method and application thereof | 广东工业大学 | 2020-04-17 | — | — | CN | disclosed |
| CN-108220755-A | A kind of method for preparing zirconium oxide-zirconium carbide particle enhancing gray cast iron | 山东建筑大学 | 2018-06-29 | — | — | CN | disclosed |
| US-5514485-A | METAL OXIDE FILMS ON SILICON OXIDE AND METAL OXIDES | ASAHI GLASS COMPANY LTD. (JP) | 1996-05-07 | — | — | US | disclosed |
| US-5464674-A | Multilayer recording element with protective coatings over oxide layer | ASAHI GLASS COMPANY LTD. (JP) | 1995-11-07 | — | — | US | disclosed |
| US-5399435-A | Durable zinc silicate coating | ASAHI GLASS COMPANY LTD. (JP) | 1995-03-21 | — | — | US | disclosed |
| EP-0331201-B1 | AMORPHOUS OXIDE FILM AND ARTICLE HAVING SUCH FILM THEREON | ASAHI GLASS COMPANY LTD. (JP) | 1993-06-09 | — | — | EP | disclosed |
| US-5209835-A | Magnetic recording media | ASAHI GLASS COMPANY LTD. (JP) | 1993-05-11 | — | — | US | disclosed |
| EP-0486475-A2 | Amorphous oxide film and article having such film thereon | ASAHI GLASS COMPANY LTD. (JP) | 1992-05-20 | — | — | EP | disclosed |
| US-5110637-A | Mixed boron oxide, glass, windows, durability | ASAHI GLASS COMPANY LTD. (JP) | 1992-05-05 | — | — | US | disclosed |
| EP-0331201-A1 | Amorphous oxide film and article having such film thereon | ASAHI GLASS COMPANY LTD. (JP) | 1989-09-06 | — | — | EP | disclosed |