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 SCHEMBL580389 | 1.00 | — | — | |
| SCHEMBL230106 | 0.87 | — | — | |
| SCHEMBL27965289 | 0.75 | — | — | |
| Water SCHEMBL7431 | 0.71 | — | — | |
| Water SCHEMBL2764964 | 0.71 | — | — | |
| Water SCHEMBL7776151 | 0.71 | — | — | |
| Water SCHEMBL7172851 | 0.71 | — | — | |
| Water SCHEMBL22871 | 0.71 | — | — | |
| Water SCHEMBL1679457 | 0.71 | — | — | |
| Water SCHEMBL17063649 | 0.71 | — | — |
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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118950093-A | Multifunctional rubber emulsion hydrogenation catalyst and preparation method and application thereof | 青岛科技大学 | 2024-11-15 | — | — | CN | claimed |
| CN-118437238-A | Method for constructing high-elasticity aerogel by controllable assembly of sub-nanowires | 内蒙古科技大学 | 2024-08-06 | — | — | CN | claimed |
| CN-118437237-A | Preparation method of sub-nanowire aerogel | 内蒙古科技大学 | 2024-08-06 | — | — | CN | claimed |
| CN-117756824-A | Preparation method and application of rare earth ternary complex | 厦门稀土材料研究所 | 2024-03-26 | — | — | CN | claimed |
| CN-117736696-A | 2:17 rare earth cobalt/graphite nano composite electromagnetic wave absorbing material and preparation method thereof | 北京航空航天大学 | 2024-03-22 | — | — | CN | claimed |
| CN-114539725-A | PET composite material and preparation method thereof | 合肥杰事杰新材料股份有限公司 | 2022-05-27 | — | — | CN | claimed |
| CN-113372281-A | Synthetic method of metronidazole | 河北中科金辉药业有限公司 | 2021-09-10 | — | — | CN | claimed |
| CN-120305262-A | Sustained-release rare earth pyridine nitrogen oxide compound and application thereof in preparation of aquatic feed | 厦门稀土材料研究所 | 2025-07-15 | — | — | CN | disclosed |
| WO-2025134039-A1 | PREPARATION OF FUNCTIONALIZED MESOPOROUS SILICA NANOPARTICLES AS MASS TAGS FOR APPLICATION IN MASS CYTOMETRY | STANDARD BIOTOOLS CANADA INC. (CA) | 2025-06-26 | — | — | WO | disclosed |
| CN-119287413-A | PrCuCoP/NF efficient electrocatalytic composite material, preparation method and application | 西安建筑科技大学 | 2025-01-10 | — | — | CN | disclosed |
| CN-118950093-A | Multifunctional rubber emulsion hydrogenation catalyst and preparation method and application thereof | 青岛科技大学 | 2024-11-15 | — | — | CN | disclosed |
| CN-118825307-A | Rare earth element doped carbon nitride supported noble metal electrocatalyst and preparation method and application thereof | 北京师范大学珠海校区 | 2024-10-22 | — | — | CN | disclosed |
| CN-118437237-A | Preparation method of sub-nanowire aerogel | 内蒙古科技大学 | 2024-08-06 | — | — | CN | disclosed |
| WO-2009080240-A2 | PROCESS FOR THE PREPARATION OF MELAMINE | DSM IP ASSETS B.V. (NL) | 2009-07-02 | — | — | WO | disclosed |
| EP-2072504-A1 | Process for the preparation of melamine | DSMIP Assets B.V. (NL) | 2009-06-24 | — | — | EP | disclosed |
| CN-1130671-A | Process for oxidation of hydrogen chloride | BAYER AG (DE) | 1996-09-11 | — | — | CN | disclosed |
| CN-1119868-A | Rare earth compounds and their preparation | TIMOTHY JOHN LEEDHAM (FR) | 1996-04-03 | — | — | CN | disclosed |
| US-5504195-A | RARE EARTH METAL COMPLEXES WITH BETA-DIKETONE LIGANDS AND POLYETHER OR POLYAMINE COMPOUNDS; METAL OXIDE PRECURSORS | RHONE-POULENC CHIMIE (FR) | 1996-04-02 | — | — | US | disclosed |
| EP-0680483-A1 | RARE EARTH COMPOUNDS AND THEIR PREPARATION | RHONE-POULENC CHIMIE (FR) | 1995-11-08 | — | — | EP | disclosed |
| WO-1994017078-A1 | RARE EARTH COMPOUNDS AND THEIR PREPARATION | RHONE-POULENC CHIMIE (FR) | 1994-08-04 | — | — | WO | disclosed |