Water

Water

SCHEMBL459240

O.O.O[Si](O)(O)O.[AlH3].[CaH2].[MgH2].[NaH]

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 SCHEMBL18108509 1.00
Water SCHEMBL222725 0.95
Water SCHEMBL5326736 0.95
Water SCHEMBL220756 0.94
Water SCHEMBL666332 0.94
SCHEMBL17785150 0.94
Water SCHEMBL665956 0.94
Fluoride SCHEMBL7034559 0.91
SCHEMBL7031962 0.89
Water SCHEMBL2403129 0.89

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024115312-A1 NON-METAL PIPE - FOR IMPROVED PIPE BENDING WAVIN B.V. (NL) 2024-06-06 WO claimed
WO-2023099498-A1 MULTI-LAYERED PIPE WAVIN B.V. (NL) 2023-06-08 WO claimed
EP-1511112-B1 Polymer nanocomposite membrane and fuel cell using the same SAMSUNG SDI CO LTD (KR) 2016-12-14 EP claimed
US-9056951-B2 Ultrastrong and stiff layered polymer nanocomposites and hierarchical laminate materials thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2015-06-16 US claimed
US-20110250427-A1 ULTRASTRONG AND STIFF LAYERED POLYMER NANOCOMPOSITES AND HIERARCHICAL LAMINATE MATERIALS THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2011-10-13 US claimed
US-20110193068-A1 Composite film, flexible substrate including the composite film, and organic light emitting device including the flexible substrate SAMSUNG DISPLAY CO., LTD. (KR) 2011-08-11 US claimed
US-7659012-B2 layered inorganic silicates, epoxy resin polymer, curing agent to form nanocomposite encapsulation layer and adhere first substrate to the second; prevent moisture and oxygen absorption SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2010-02-09 US claimed
WO-2009085362-A2 ULTRASTRONG AND STIFF LAYERED POLYMER NANOCOMPOSITES AND HIERARCHICAL LAMINATE MATERIALS THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2009-07-09 WO claimed
US-7368198-B2 Polymer nanocomposite membrane and fuel cell using the same SAMSUNG SDI CO., LTD. (KR) 2008-05-06 US claimed
US-20060269816-A1 Proton conducting inorganic material, polymer nano-composite membrane including the same, and fuel cell adopting the polymer nano-composite membrane SAMSUNG SDI CO., LTD. (KR) 2006-11-30 US claimed
US-20050170210-A1 Organic electroluminescent display device SAMSUNG DISPLAY CO., LTD. (KR) 2005-08-04 US claimed
US-20050084728-A1 Polymer nanocomposite membrane and fuel cell using the same SAMSUNG SDI CO., LTD. (KR) 2005-04-21 US claimed
EP-1511112-A1 Polymer nanocomposite membrane and fuel cell using the same Samsung SDI Co., Ltd. (KR) 2005-03-02 EP claimed
US-20240238359-A1 PHARMACEUTICLA COMPOSITION FOR PREVENTION OR TREATMENT OF VIRUS-INDUCED DISEASE QUR MEDICAL APS (DK) 2024-07-18 US disclosed
WO-2024115312-A1 NON-METAL PIPE - FOR IMPROVED PIPE BENDING WAVIN B.V. (NL) 2024-06-06 WO disclosed
EP-4319784-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTION OR TREATMENT OF VIRUS-INDUCED DISEASE QUR Medical ApS (DK) 2024-02-14 EP disclosed
EP-1513561-A2 SKIN ADHESIVE FOR CUSHIONS AND WOUND DRESSINGS Corium International (US) 2005-03-16 EP disclosed
EP-1511112-A1 Polymer nanocomposite membrane and fuel cell using the same Samsung SDI Co., Ltd. (KR) 2005-03-02 EP disclosed
WO-2003099344-A2 SKIN ADHESIVE FOR CUSHIONS AND WOUND DRESSINGS CORIUM INTERNATIONAL (US) 2003-12-04 WO disclosed
US-20030225356-A1 Composition for cushions, wound dressings and other skin-contacting products COLUMBUS INVESTMENT HOLDINGS SA (CH) 2003-12-04 US disclosed