Water

Water

SCHEMBL2380464

O.O=[Si]([O-])[O-].O=[Si]([O-])[O-].[Al+3].[K+]

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 SCHEMBL5191861 1.00
Water SCHEMBL5089772 0.95
Water SCHEMBL226529 0.95
Water SCHEMBL226049 0.95
Water SCHEMBL222476 0.95
Water SCHEMBL2404103 0.94
Water SCHEMBL4856157 0.94
Water SCHEMBL19250732 0.94
Potassium Ion SCHEMBL250558 0.94
Water SCHEMBL781993 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 52 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090211720-A1 Composite Materials, Method for Their Preparation, and Use in Paper and Board Manufacturing KEMIRA OYJ (FI) 2009-08-27 US claimed
EP-1858958-A1 NEW COMPOSITE MATERIALS, METHOD FOR THEIR PREPARATION AND USE IN PAPER AND BOARD MANUFACTURING Kemira Oyj (FI) 2007-11-28 EP claimed
WO-2006097571-A1 NEW COMPOSITE MATERIALS, METHOD FOR THEIR PREPARATION AND USE IN PAPER AND BOARD MANUFACTURING KEMIRA OYJ (FI) 2006-09-21 WO claimed
JP-63010711-A None JP disclosed
CN-114829409-B Combinations of cross-linking agents to improve coating properties 巴斯夫欧洲公司 2024-12-24 CN disclosed
US-20240368036-A1 NANO-MODIFIED WATERPROOF SEALER COMPOSITIONS AND METHODS FOR CONCRETE PRESERVATION UNIV WASHINGTON STATE (US) 2024-11-07 US disclosed
CN-118900777-A Method for producing printed matter and active energy ray-curable ink 东丽株式会社 2024-11-05 CN disclosed
CN-114341285-B High performance, fast curing coatings 巴斯夫欧洲公司 2024-03-22 CN disclosed
CN-113330086-B curable composition 巴斯夫欧洲公司 2023-11-03 CN disclosed
WO-2023054026-A1 METHOD FOR MANUFACTURING PRINTED MATTER 東レ株式会社 2023-04-06 WO disclosed
WO-2023023508-A1 NANO-MODIFIED WATERPROOF SEALER COMPOSITIONS AND METHODS FOR CONCRETE PRESERVATION WASHINGTON STATE UNIVERSITY (US) 2023-02-23 WO disclosed
CN-102088946-A Compositions for topical application comprising microencapsulated colorants TAGRA BIOTECHNOLOGIES LTD 2011-06-08 CN disclosed
CN-101952360-A Scrub and stain resistant coating compositions, methods of making the same, and articles comprising the same MASCO CORP 2011-01-19 CN disclosed
US-20090211720-A1 Composite Materials, Method for Their Preparation, and Use in Paper and Board Manufacturing KEMIRA OYJ (FI) 2009-08-27 US disclosed
EP-1858958-A1 NEW COMPOSITE MATERIALS, METHOD FOR THEIR PREPARATION AND USE IN PAPER AND BOARD MANUFACTURING Kemira Oyj (FI) 2007-11-28 EP disclosed
WO-2006097571-A1 NEW COMPOSITE MATERIALS, METHOD FOR THEIR PREPARATION AND USE IN PAPER AND BOARD MANUFACTURING KEMIRA OYJ (FI) 2006-09-21 WO disclosed
JP-2000202301-A ORGANIC SUBSTANCE-DECOMPOSED BODY AND ITS PRODUCTION SHARP CORP 2000-07-25 JP disclosed
US-5148565-A Method for making a rubber boot containing heat reflecting means NORCROSS FOOTWEAR, INC. (US) 1992-09-22 US disclosed
US-5068982-A Rubber boot containing heat reflecting means SERVUS RUBBER COMPANY (US) 1991-12-03 US disclosed
JP-S6310711-A LIP COSMETIC POLA CHEM IND INC 1988-01-18 JP disclosed