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 SCHEMBL3480829 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL184414 | 0.82 | — | — | |
| Water SCHEMBL21293771 | 0.67 | — | — | |
| Water SCHEMBL21379772 | 0.67 | — | — | |
| Water SCHEMBL22558537 | 0.67 | — | — | |
| Water SCHEMBL23461833 | 0.67 | — | — | |
| Water SCHEMBL23631871 | 0.67 | — | — | |
| Water SCHEMBL25334174 | 0.67 | — | — | |
| Water SCHEMBL21293770 | 0.67 | — | — | |
| Water SCHEMBL25188536 | 0.67 | — | — |
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 60 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114029012-B | Preparation method of microcapsule taking metal organic coordination polymer as wall material | 西湖大学 | 2024-11-12 | — | — | CN | claimed |
| CN-118880385-A | Preparation method and application of high-performance scandium-doped ruthenium oxide acidic oxygen evolution electrocatalyst | 华东理工大学 | 2024-11-01 | — | — | CN | claimed |
| CN-114618441-B | Controllable preparation method of MIL material and application of MIL material in separation and enrichment of polyalcohol | 中国科学院大连化学物理研究所 | 2023-07-04 | — | — | CN | claimed |
| CN-114618441-A | Controllable preparation method of MIL material and application of MIL material in separation and enrichment of polyhydric alcohol | 中国科学院大连化学物理研究所 | 2022-06-14 | — | — | CN | claimed |
| CN-114408968-A | Rare earth stabilized zirconia nano powder and preparation method thereof | 山东理工大学 | 2022-04-29 | — | — | CN | claimed |
| CN-113072090-A | Preparation method of anhydrous scandium chloride molten salt | 中国恩菲工程技术有限公司 | 2021-07-06 | — | — | CN | claimed |
| CN-110060830-B | Preparation method of magnetic nano functional material | 赣州富尔特电子股份有限公司 | 2020-12-18 | — | — | CN | claimed |
| CN-111253351-A | Controllable preparation of MIL material and application of MIL material in separation and enrichment of furan compound | 中国科学院大连化学物理研究所 | 2020-06-09 | — | — | CN | claimed |
| CN-110060830-A | The preparation method of magnetic Nano functional material | 吴荣臻 | 2019-07-26 | — | — | CN | claimed |
| US-20250182921-A1 | Neutron shielding materials selection method | TOKAMAK ENERGY LTD (GB) | 2025-06-05 | — | — | US | disclosed |
| EP-4544573-A1 | NEUTRON SHIELDING MATERIALS SELECTION METHOD | Tokamak Energy Ltd (GB) | 2025-04-30 | — | — | EP | disclosed |
| CN-119663355-A | Transition metal compound nano-array loaded copper nanocluster electrode and preparation method and application thereof | 中山大学 | 2025-03-21 | — | — | CN | disclosed |
| CN-119422210-A | Neutron shielding material selection method | 托卡马克能量有限公司 | 2025-02-11 | — | — | CN | disclosed |
| CN-119381485-A | Preparation method of doped zirconia electrolyte and electrolyte support SOC unit | 成都云海星河科技服务有限公司 | 2025-01-28 | — | — | CN | disclosed |
| US-6645905-B2 | Contacting mixed metal oxide with liquid selected from organic acids, alcohols, inorganic acids and hydrogen peroxide; recovering insoluble material; calcining insoluble material; mixing with promoter in solvent; removing solvent; calcining | ROHM AND HAAS COMPANY | 2003-11-11 | — | — | US | disclosed |
| US-20030004379-A1 | Hydrothermally synthesized MO-V-M-X oxide catalysts for the selective oxidation of hydrocarbons | ROHM AND HAAS COMPANY | 2003-01-02 | — | — | US | disclosed |
| EP-1270068-A1 | Hydrothermally synthesized Mo-V-M-X oxide catalysts for the selective oxidation of hydrocarbons | ROHM AND HAAS COMPANY (US) | 2003-01-02 | — | — | EP | disclosed |
| US-20020183198-A1 | Annealed and promoted catalyst | ROHM AND HAAS COMPANY | 2002-12-05 | — | — | US | disclosed |
| EP-1254706-A2 | Annealed and promoted catalyst | ROHM AND HAAS COMPANY (US) | 2002-11-06 | — | — | EP | disclosed |
| US-20020062042-A1 | PROMOTED MULTI-METAL OXIDE CATALYST | ROHM AND HAAS COMPANY | 2002-05-23 | — | — | US | disclosed |