Water

Water

SCHEMBL176514

O.O.O.O=[N+]([O-])[O-].[Li+]

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 SCHEMBL27967378 1.00 MEN1 (0.67)
Water SCHEMBL5960033 1.00 MEN1 (0.67)
Water SCHEMBL1829896 1.00
Water SCHEMBL8752018 1.00
Water SCHEMBL7857556 1.00 MEN1 (0.67)
Water SCHEMBL28699228 0.94 MEN1 (0.60)
Water SCHEMBL28699226 0.94 MEN1 (0.60)
Water SCHEMBL27658399 0.94
Water SCHEMBL17500219 0.94 MEN1 (0.60)
Ammonia Solution, Strong SCHEMBL10950233 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 712 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122071624-A Composite phase-change heat storage material and preparation method thereof 国能榆林能源有限责任公司 2026-05-22 CN claimed
US-12433851-B2 Controlling water release from a dimensionally stable aqueous composition LTS LOHMANN THERAPIE-SYSTEME AG (DE) 2025-10-07 US claimed
EP-4581064-A1 PREPARATION OF SILANE-GRAFTED EPDM AND MOISTURE CURING THEREOF Airboss of America Corp. (CA) 2025-07-09 EP claimed
CN-120026805-A Smart window and preparation method thereof 深圳市弗赛格能源技术有限公司 2025-05-23 CN claimed
WO-2025040527-A2 PRODUCING LAMINATES COMPOSED OF LISICON MATERIAL EVONIK OPERATIONS GMBH (DE) 2025-02-27 WO claimed
EP-4509635-A1 PRODUCTION OF LAYERED BODIES FROM A LISICON MATERIAL Evonik Operations GmbH (DE) 2025-02-19 EP claimed
CN-119101897-A Preparation method of high-temperature-resistant corrosion-resistant aluminum alloy material 扬州润实新材料科技有限公司 2024-12-10 CN claimed
CN-117587288-B High-temperature-resistant corrosion-resistant aluminum alloy material and preparation method thereof 重庆生普石油设备制造有限公司 2024-11-01 CN claimed
CN-114851642-B Bionic structure for high-efficiency energy aggregation and storage, and preparation method and application thereof 中国科学院苏州纳米技术与纳米仿生研究所 2024-10-29 CN claimed
CN-118851692-A Phase-change heat storage building block and sunlight greenhouse 北京锦绣新技术发展有限公司 2024-10-29 CN claimed
EP-0531464-B1 STORAGE SALT MIXTURES HOERMANSDOERFER GERD (DE) 1996-02-28 EP claimed
EP-0531464-A1 STORAGE SALT MIXTURES. HOERMANNSDOERFER GERD (DE) 1993-03-17 EP claimed
WO-1992012217-A1 STORAGE SALT MIXTURES HOERMANNSDOERFER GERD (DE) 1992-07-23 WO claimed
US-4871615-A Temperature-adaptable textile fibers and method of preparing same THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1989-10-03 US claimed
US-4856294-A Micro-climate control vest MAINSTREAM ENGINEERING CORPORATION (US) 1989-08-15 US claimed
US-4851291-A Temperature adaptable textile fibers and method of preparing same THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1989-07-25 US claimed
EP-0103450-B1 LATENT HEAT STORAGE AND SUPPLY SYSTEM AND METHOD AMERICAN HOSPITAL SUPPLY CORPORATION (US) 1986-07-30 EP claimed
US-4503838-A Latent heat storage and supply system and method AMERICAN HOSPITAL SUPPLY CORPORATION (US) 1985-03-12 US claimed
EP-0103450-A1 Latent heat storage and supply system and method AMERICAN HOSPITAL SUPPLY CORPORATION (US) 1984-03-21 EP claimed
US-4319626-A Chemical storage of energy MARTIN MARIETTA CORP. (US) 1982-03-16 US claimed