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 SCHEMBL9133643 | 1.00 | — | — | |
| Water SCHEMBL9245035 | 0.87 | — | — | |
| SCHEMBL8724001 | 0.82 | — | — | |
| SCHEMBL8203672 | 0.82 | — | — | |
| SCHEMBL2179 | 0.82 | — | — | |
| SCHEMBL5867087 | 0.82 | — | — | |
| Water SCHEMBL14576236 | 0.82 | — | — | |
| SCHEMBL11062055 | 0.82 | — | — | |
| SCHEMBL93246 | 0.82 | — | — | |
| SCHEMBL9998309 | 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
Appears in 4858 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-12630929-B2 | Method for producing a flat steel product having a protective zinc-based metal layer and a phosphating layer produced on a surface of the protective metal layer and flat steel product of this type | THYSSENKRUPP STEEL EUROPE AG (DE) | 2026-05-19 | — | — | US | claimed |
| EP-4731576-A1 | PROCESS FOR THE TREATMENT OF RESIDUES OF THE ALUMINA REFINING INDUSTRY, OBTAINING VALORIZABLE PRODUCTS AND SECONDARY RAW MATERIALS, IN ACCORDANCE WITH THE STRATEGIES OF THE CIRCULATORY ECONOMY | Ecotec Gestione Impianti S.r.l. (IT) | 2026-04-29 | — | — | EP | claimed |
| US-20250132342-A1 | ALL-SOLID-STATE RECHARGEABLE BATTERY | SAMSUNG SDI CO LTD (KR) | 2025-04-24 | — | — | US | claimed |
| CN-119812274-A | Negative electrode material of sodium ion battery and preparation method thereof | 万华化学集团股份有限公司 | 2025-04-11 | — | — | CN | claimed |
| CN-222667304-U | Enamelled steel sheet with excellent light reflection effect | 江苏新丽源南亚新材料有限公司 | 2025-03-25 | — | — | CN | claimed |
| CN-119372485-A | Method for extracting products from titanium-containing materials | 阿瓦塔纳有限公司 | 2025-01-28 | — | — | CN | claimed |
| WO-2024261518-A1 | PROCESS FOR THE TREATMENT OF RESIDUES OF THE ALUMINA REFINING INDUSTRY, OBTAINING VALORIZABLE PRODUCTS AND SECONDARY RAW MATERIALS, IN ACCORDANCE WITH THE STRATEGIES OF THE CIRCULATORY ECONOMY | ECOTEC GESTIONE IMPIANTI S.R.L. (IT) | 2024-12-26 | — | — | WO | claimed |
| US-12172905-B2 | Methods of extraction of products from titanium-bearing materials | AVERTANA LIMITED (NZ) | 2024-12-24 | — | — | US | claimed |
| CN-118307032-A | Composite material, preparation method thereof and battery | 北方奥钛纳米技术有限公司 | 2024-07-09 | — | — | CN | claimed |
| CN-118255386-A | Concentrated photoactive, neutral titania sols | 东纳斯公司 | 2024-06-28 | — | — | CN | claimed |
| US-4268422-A | Titanium dioxide hydrate of a particular structure and process of manufacture thereof | KRONOS TITAN G.M.B.H. (DE) | 1981-05-19 | — | — | US | claimed |
| US-4196101-A | HYDROLYSIS OF A TITANIUM COMPOUND, CALCINING | FILTROL CORPORATION (US) | 1980-04-01 | — | — | US | claimed |
| US-4168297-A | TITANIUM DIOXIDE | ALLIED CHEMICAL CORPORATION (US) | 1979-09-18 | — | — | US | claimed |
| US-4150986-A | TITANIUM DIOXIDE | ISHIHARA SANGYO KAISHA, LTD. (JP) | 1979-04-24 | — | — | US | claimed |
| US-4107264-A | Recovery of TiO2 from ilmenite-type ore by a membrane based electrodialysis process | ALLIED CHEMICAL CORPORATION (US) | 1978-08-15 | — | — | US | claimed |
| US-4085190-A | Production of rutile from ilmenite | SHIAH CHYN DUOG | 1978-04-18 | — | — | US | claimed |
| US-4036662-A | CALCINING | BAYER AKTIENGESELLSCHAFT (DT) | 1977-07-19 | — | — | US | claimed |
| US-4005175-A | SULFATE PROCESS | SOCIETA' ITALIANA RESINE S.I.R. S.P.A. (IT) | 1977-01-25 | — | — | US | claimed |
| US-3981978-A | Working up aqueous titanium dioxide hydrate suspensions | BAYER ANTWERPEN N.V. (BE) | 1976-09-21 | — | — | US | claimed |
| US-3962488-A | TITANIUM DIOXIDE | PPG INDUSTRIES, INC. (US) | 1976-06-08 | — | — | US | claimed |