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 SCHEMBL4461991 | 1.00 | — | — | |
| Water SCHEMBL28074298 | 1.00 | — | — | |
| Methane SCHEMBL28853165 | 0.94 | — | — | |
| Water SCHEMBL4973907 | 0.94 | — | — | |
| Water SCHEMBL9455540 | 0.94 | — | — | |
| Water SCHEMBL4976561 | 0.94 | — | — | |
| Methane SCHEMBL13276322 | 0.94 | — | — | |
| Water SCHEMBL28649661 | 0.94 | — | — | |
| Methane SCHEMBL28901286 | 0.94 | — | — | |
| SCHEMBL10805026 | 0.93 | — | — |
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 114 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3202808-B1 | GEL PARTICLES, INK COMPOSITION AND PRODUCTION METHOD THEREOF, PHOTOSENSITIVE COMPOSITION, AND IMAGE FORMING METHOD | FUJIFILM CORP (JP) | 2023-03-01 | — | — | EP | claimed |
| CN-108592515-B | Control method of refrigeration house refrigeration system | 北京中冷高科制冷设备有限公司 | 2020-11-10 | — | — | CN | claimed |
| CN-108799837-A | A kind of remodeling method of liquefied ammonia refrigeration freezer | 北京中冷高科制冷设备有限公司 | 2018-11-13 | — | — | CN | claimed |
| CN-103992720-B | A kind of acrylic acid top-coat special-purpose coat and its preparation method | JIANGSU XIN'AN NEW MATERIALS TECHNOLOGY CO., LTD. (CN) | 2016-06-01 | — | — | CN | claimed |
| CN-1323292-A | Benzoylcyclohexanediones, process for their preparation and their use as herbicides and plant growth regulators | AVENTIS CROPSCIENCE GMBH (DE) | 2001-11-21 | — | — | CN | claimed |
| US-12624180-B2 | In-situ formation of low density thermoplastic polyurethane flexible foams | HUNTSMAN INTERNATIONAL LLC | 2026-05-12 | — | — | US | disclosed |
| US-12545016-B2 | Surface protection film | BANDO CHEMICAL INDUSTRIES, LTD. (JP) | 2026-02-10 | — | — | US | disclosed |
| EP-4630506-A1 | AQUEOUS INTERPENETRATING POLYMER NETWORK | The University of Sydney (AU) | 2025-10-15 | — | — | EP | disclosed |
| US-20250171579-A1 | POLYETHER POLYOL COMPOSITION FOR PRODUCING VISOELASTIC POLYURETHANE FOAMS | PCC ROKITA SPOLKA AKCYJNA (PL) | 2025-05-29 | — | — | US | disclosed |
| WO-2025100151-A1 | POLYURETHANE FOAM DECOMPOSITION TREATMENT APPARATUS, POLYURETHANE FOAM DECOMPOSITION TREATMENT METHOD, AND REACTION PRODUCT PRODUCTION METHOD | ＢＡＳＦ ＩＮＯＡＣポリウレタン株式会社 | 2025-05-15 | — | — | WO | disclosed |
| EP-3412730-B1 | AQUEOUS DISPERSION, PRODUCTION METHOD THEREFOR, AND IMAGE FORMATION METHOD | FUJIFILM CORP (JP) | 2025-03-19 | — | — | EP | disclosed |
| CN-119487255-A | Fiber-treating agent for rubber reinforcement, set of fiber-treating agents for rubber reinforcement, method for producing fiber for rubber reinforcement, and rubber product | 明成化学工业株式会社 | 2025-02-18 | — | — | CN | disclosed |
| EP-0220697-B1 | PROCESS FOR PRODUCING POLYURETHANE FOAMS USING FOAM MODIFIERS | UNION CARBIDE CORPORATION (US) | 1990-09-05 | — | — | EP | disclosed |
| US-4686240-A | ALKALI OR ALKALINE EARTH METAL SALT OF A BRONSTED ACID | UNION CARBIDE CORPORATION (US) | 1987-08-11 | — | — | US | disclosed |
| EP-0220697-A2 | Process for producing polyurethane foams using foam modifiers | UNION CARBIDE CORPORATION (US) | 1987-05-06 | — | — | EP | disclosed |
| US-4608407-A | AMINE SALTS OF PHOSPHORUS-CONTAINING COMPOUNDS | BAYER AKTIENGESELLSCHAFT (DE) | 1986-08-26 | — | — | US | disclosed |
| US-4374055-A | ODORS, PERFUMES | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1983-02-15 | — | — | US | disclosed |
| US-4359395-A | Process for enhancing the organoleptic properties of perfumed articles using alkyl esters of 1-alkanolyl cycloalkanols | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1982-11-16 | — | — | US | disclosed |
| US-4327749-A | Alkyl esters of 1-alkanoyl cycloalkanols, process for preparing same and organoleptic uses thereof | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1982-05-04 | — | — | US | disclosed |
| US-4256848-A | Synergistic polyurethane co-catalysts which are a combination of an organo-mercuric compound and a zinc salt of an alkyl carboxylic acid | BASF WYANDOTTE CORPORATION (US) | 1981-03-17 | — | — | US | disclosed |