Water

Water

SCHEMBL60220

O.O=C([O-])O[O-].[Na+].[Na+]

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 SCHEMBL11774765 1.00
Water SCHEMBL303843 1.00 CA4 (0.43)
Water SCHEMBL9137498 1.00 CA4 (0.43)
SCHEMBL8770399 0.96 CA4 (0.46)
SCHEMBL22781 0.96
Potassium Ion SCHEMBL7857699 0.92
SCHEMBL1679884 0.92
Bicarbonate SCHEMBL6047560 0.92 CA4 (0.43)
Hydrogen Peroxide SCHEMBL4303609 0.92
Bicarbonate SCHEMBL7106290 0.88 CA4 (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170002303-A1 TABLET BINDING COMPOSITIONS CHEMLINK LABORATORIES, LLC (US) 2017-01-05 US claimed
US-8877240-B1 Tablet binding compositions CHEMLINK LABORATORIES, LLC (US) 2014-11-04 US claimed
WO-2009126560-A2 LAUNDRY COMPOSITIONS DIAMOND CHEMICAL COMPANY, INC. (US) 2009-10-15 WO claimed
US-20080188392-A1 Laundry Compositions DIAMOND CHEMICAL COMPANY, INC. (US) 2008-08-07 US claimed
WO-2006072072-A2 LAUNDRY COMPOSITIONS DIAMOND CHEMICAL COMPANY, INC. (US) 2006-07-06 WO claimed
EP-1567632-A4 NEW CLASS OF LAUNDRY COMPOSITIONS DIAMOND CHEMICAL COMPANY INC (US) 2006-03-08 EP claimed
EP-1567632-A2 NEW CLASS OF LAUNDRY COMPOSITIONS Diamond Chemical Company, Inc. (US) 2005-08-31 EP claimed
US-20050170986-A1 Laundry compositions DIAMOND CHEMICAL COMPANY, INC. 2005-08-04 US claimed
WO-2004050810-A2 NEW CLASS OF LAUNDRY COMPOSITIONS DIAMOND CHEMICAL COMPANY, INC. (US) 2004-06-17 WO claimed
CN-114728092-B Edge block with improved odor performance 西姆莱斯股份公司 2025-02-28 CN disclosed
EP-3339412-B2 FAST DISSOLVING SOLID DETERGENT ECOLAB USA INC (US) 2024-03-27 EP disclosed
CN-117586986-A Compositions and methods comprising lipolytic enzyme variants 丹尼斯科美国公司 2024-02-23 CN disclosed
CN-110093330-B Compositions and methods comprising lipolytic enzyme variants 丹尼斯科美国公司 2023-11-28 CN disclosed
US-11261406-B2 Fast dissolving solid detergent ECOLAB USA INC. (US) 2022-03-01 US disclosed
EP-0740521-A1 DIACYL AND TETRAACYL PEROXIDES TO INHIBIT TRANSFER OF BLEACHABLE FOOD SOIL IN MACHINE DISHWASHING THE PROCTER & GAMBLE COMPANY (US) 1996-11-06 EP disclosed
EP-0578987-B1 Process for the preparation of a mixture of sodium silicate and another salt and use of this mixture HOECHST AG (DE) 1996-01-03 EP disclosed
WO-1995019132-A1 DIACYL AND TETRAACYL PEROXIDES TO INHIBIT TRANSFER OF BLEACHABLE FOOD SOIL IN MACHINE DISHWASHING THE PROCTER & GAMBLE COMPANY (US) 1995-07-20 WO disclosed
EP-0659874-A1 Detergent compositions THE PROCTER & GAMBLE COMPANY (US) 1995-06-28 EP disclosed
EP-0578987-A1 Process for the preparation of a mixture of sodium silicate and another salt and use of this mixture HOECHST AKTIENGESELLSCHAFT (DE) 1994-01-19 EP disclosed
US-4526698-A Coating agent comprises borate compound such as sodium tetraborate KAO CORPORATION (JP) 1985-07-02 US disclosed