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 SCHEMBL993247 | 1.00 | — | — | |
| Water SCHEMBL11226840 | 1.00 | — | — | |
| Fluoride SCHEMBL8671306 | 0.87 | — | — | |
| Fluoride Ion SCHEMBL779 | 0.82 | — | — | |
| Fluoride Ion SCHEMBL1943306 | 0.82 | — | — | |
| Water SCHEMBL23118087 | 0.67 | — | — | |
| Water SCHEMBL11364888 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL9496122 | 0.67 | — | — | |
| Water SCHEMBL25293755 | 0.67 | — | — | |
| Fluoride Ion SCHEMBL6756047 | 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 467 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3431520-B1 | PROCESS FOR PRODUCING OXYMETHYLENE COPOLYMER | MITSUBISHI GAS CHEMICAL CO (JP) | 2025-09-24 | — | — | EP | claimed |
| WO-2025119863-A1 | PHOTOCURABLE COMPOSITION COMPRISING N-HEPTYLCYANOACRYLATE, N-HEXYLCYANOACRYLATE OR N-OCTYLCYANOACRYLATE | BOSTIK SA (FR) | 2025-06-12 | — | — | WO | claimed |
| EP-4567051-A1 | PHOTOCURABLE COMPOSITION COMPRISING N-HEPTYLCYANOACRYLATE, N-HEXYLCYANOACRYLATE OR N-OCTYLCYANOACRYLATE | Bostik SA (FR) | 2025-06-11 | — | — | EP | claimed |
| EP-3960151-B1 | PHOTOCURABLE CYANOACRYLATE COMPOSITION WITH CONTROLLED EXOTHERM | CUANTUM MEDICAL COSMETICS S L (ES) | 2025-04-23 | — | — | EP | claimed |
| CN-117753449-A | Sulfuration type hydrogenation catalyst, preparation method and application thereof | 中国石油化工股份有限公司 | 2024-03-26 | — | — | CN | claimed |
| US-20230159485-A1 | Methods for Preparing Cannabinoids and Related Instruments | 3BC, LLC (US) | 2023-05-25 | — | — | US | claimed |
| CN-115995598-A | Multifunctional sodium battery electrolyte additive and application thereof | 中国科学院物理研究所 | 2023-04-21 | — | — | CN | claimed |
| US-20220258410-A1 | 3D-PRINTING METHODS AND SYSTEMS | BOSTIK SA (FR) | 2022-08-18 | — | — | US | claimed |
| CN-114824468-A | Multifunctional lithium battery additive containing fluorine and boron substances and application thereof | 中国科学院物理研究所 | 2022-07-29 | — | — | CN | claimed |
| CN-113860257-B | Method and system for regenerating and recycling glass thinning waste acid liquor | 浙江容跃环保科技有限公司 | 2022-04-22 | — | — | CN | claimed |
| US-20030149298-A1 | Cracking of neo-C9 and neo-C13 carboxylic acids to either pivalic acid or methyl pivalate | MOZELESKI EDMUND J (US) | 2003-08-07 | — | — | US | claimed |
| EP-1292602-A4 | NEW CHIRAL SALEN CATALYST AND METHODS FOR THE PREPARATION OF CHIRAL COMPOUNDS FROM RACEMIC EPOXIDES BY USING NEW CATALYST | RS TECH CORP (KR) | 2003-07-09 | — | — | EP | claimed |
| EP-1292602-A1 | NEW CHIRAL SALEN CATALYST AND METHODS FOR THE PREPARATION OF CHIRAL COMPOUNDS FROM RACEMIC EPOXIDES BY USING NEW CATALYST | RS Tech Corp. (KR) | 2003-03-19 | — | — | EP | claimed |
| US-20030028049-A1 | Cracking of neo-C9 and neo-C13 carboxylic acids to either pivalic acid or methyl pivalate | EXXONMOBIL CHEMICAL PATENTS INC. | 2003-02-06 | — | — | US | claimed |
| WO-2003006415-A1 | CRACKING OF NEO-C9 AND NEO-C13 CARBOXYLIC ACIDS TO EITHER PIVALIC ACID OR METHYL PIVALATE | EXXONMOBIL CHEMICAL PATENTS, INC. (US) | 2003-01-23 | — | — | WO | claimed |
| WO-2003002582-A1 | NEW CHIRAL SALEN CATALYST AND METHODS FOR THE PREPARATION OF CHIRAL COMPOUNDS FROM RACEMIC EPOXIDES BY USING NEW CATALYST | RS TECH CORP. (KR) | 2003-01-09 | — | — | WO | claimed |
| EP-0748783-B1 | Production of monoolefin oligomer | AMOCO CORP (US) | 1999-04-14 | — | — | EP | claimed |
| US-5877375-A | ONE STEP | AMOCO CORPORATION (US) | 1999-03-02 | — | — | US | claimed |
| EP-0748783-A1 | Production of monoolefin oligomer | AMOCO CORPORATION (US) | 1996-12-18 | — | — | EP | claimed |
| US-3978144-A | MANUFACTURE OF O-BENZYLTOLUENES | BASF AKTIENGESELLSCHAFT (DT) | 1976-08-31 | — | — | US | claimed |