Water

Water

SCHEMBL3913449

O.O=S(=O)(O)OCCO

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

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.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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.

Compoundsimilaritytop predictedshared targets
Water SCHEMBL20359822 0.97 TSHR (0.33)
Water SCHEMBL15740533 0.97 TSHR (0.33)
SCHEMBL126225 0.97
SCHEMBL27837209 0.94
Sulfuric Acid SCHEMBL8718734 0.94 CA5A (0.35)
SCHEMBL3280242 0.94
SCHEMBL27572660 0.94
SCHEMBL11876704 0.94
Ethylene Glycol SCHEMBL20360050 0.94 TSHR (0.35)
Ammonia Solution, Strong SCHEMBL3497099 0.94

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 108 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118846458-A Composite foam extinguishing agent containing chemical auxiliary agent and preparation method thereof 中船九江海洋装备(集团)有限公司 2024-10-29 CN claimed
CN-117836335-A Oleophobic fluoropolymer and fibrous material made therefrom 恩特格里斯公司 2024-04-05 CN claimed
EP-3621437-B1 USE OF N-ALKYL GLUCAMIDES FOR REDUCING DRIFT DURING THE APPLICATION OF GLUFOSINATE-CONTAINING PLANT TREATMENT AGENTS CLARIANT INT LTD (CH) 2023-07-12 EP claimed
EP-3232780-B1 AQUEOUS ELECTROLYTE-CONTAINING ADJUVANT COMPOSITIONS, ACTIVE INGREDIENT-CONTAINING COMPOSITIONS AND THE USE THEREOF CLARIANT INT LTD (CH) 2021-08-04 EP claimed
EP-3621437-A1 USE OF N-ALKYL GLUCAMIDES FOR REDUCING DRIFT DURING THE APPLICATION OF GLUFOSINATE-CONTAINING PLANT TREATMENT AGENTS Clariant International Ltd (CH) 2020-03-18 EP claimed
US-20200060266-A1 Use Of N-Alkyl Glucamides For Reducing Drift During The Application Of Glufosinate-Containing Plant Treatment Agents CLARIANT INTERNATIONAL LTD. (CH) 2020-02-27 US claimed
US-20180192644-A1 Aqueous Electrolyte-Containing Adjuvant Compositons, Active Ingredient-Containing Compositions And The Use Thereof CLARIANT INTERNATIONAL LTD. (CH) 2018-07-12 US claimed
CN-106571232-A Conductive polymer fluid suspension and solid electrolytic capacitor with the same 丰宾电子(深圳)有限公司 2017-04-19 CN claimed
US-9215868-B2 Low-foam preparations for crop protection BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-12-22 US claimed
CN-1109576-C Process for producing hydrotalcites and their metal oxides TECSACO AG (DE) 2003-05-28 CN claimed
CN-1171979-A Process for producing hydrotalcites and their metal oxides RWE DEA AG (DE) 1998-02-04 CN claimed
US-4476037-A INCLUDING A MONO-OR DISULFATE OF A POLYOX= ALKYLENE GLYCOL AS FLOWCONTROL AGENT HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1984-10-09 US claimed
US-12604897-B2 Iminodipropionate surfactants for agricultural use SPECIALTY OPERATIONS FRANCE (FR) 2026-04-21 US disclosed
EP-4210073-B1 PRODUCTION METHOD FOR METAL WIRING AND KIT ASAHI CHEMICAL IND (JP) 2025-10-22 EP disclosed
US-20250057165-A1 METHOD OF FORMING A READY-TO-USE AGRICULTURAL COMPOSITION COMPRISING GLUFOSINATE NOURYON CHEMICALS INTERNATIONAL B.V. (NL) 2025-02-20 US disclosed
CN-114072675-B Polymer fibers having a backbone comprising a positively charged component of zwitterionic moieties 康奈尔大学 2025-02-18 CN disclosed
US-5565416-A COMPRISING A PHENOLIC COMPOUND AND A HYDROXIDE-BEARING COMPOUNDS CAPABLE OF IMPARTING A PH OF NINE TO WATER PHILLIPS PETROLEUM COMPANY (US) 1996-10-15 US disclosed
EP-0708631-A1 HIGH LATHERING CONDITIONING SHAMPOOS THE PROCTER & GAMBLE COMPANY (US) 1996-05-01 EP disclosed
WO-1995002388-A2 HIGH LATHERING CONDITIONING SHAMPOOS THE PROCTER & GAMBLE COMPANY (US) 1995-01-26 WO disclosed
US-4795632-A ACRYLALDEHYDE-ACRYLIC ACID COPOLYMER AND PHOSPHATE OR PHOSPHONATE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1989-01-03 US disclosed