Water

Water

SCHEMBL7431

O.[BaH2]

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 SCHEMBL28997562 1.00
Water SCHEMBL2764964 1.00
Water SCHEMBL28672199 1.00
Water SCHEMBL3782442 1.00
Water SCHEMBL22871 1.00
Water SCHEMBL17063649 1.00
Water SCHEMBL7776151 1.00
Water SCHEMBL7172851 1.00
Water SCHEMBL1679457 1.00
Water SCHEMBL74151 1.00

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

Appears in 153801 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260145994-A1 HIGH-STRENGTH, HIGHLY TRANSPARENT NANO-GLASS-CERAMIC, PREPARATION METHOD THEREFOR, AND USE THEREOF HUNAN JINGCI NEW MATERIALS CO., LTD. (CN) 2026-05-28 US claimed
EP-4747338-A1 HYBRID GREASES MADE WITH ANHYDROUS METAL SOAPS AND OVER-BASED METAL DETERGENTS AND METHODS OF MAKING The Lubrizol Corporation (US) 2026-05-27 EP claimed
CN-122079717-A Efficient oxygen deleting reagent and application thereof in carbon resource molecular skeleton deoxidizing reconstruction 2026-05-26 CN claimed
CN-122079609-A Fusion casting low-silicon low-sodium AZS brick and preparation method thereof 2026-05-26 CN claimed
CN-122079800-A Preparation method and analysis method of trans-4-amino-cyclohexyl acetic acid 2026-05-26 CN claimed
CN-122079827-A Method for preparing medical dicyandiamide by urea pyrolysis 2026-05-26 CN claimed
CN-114868298-B Composite stripping method Guangdong Haozhi Technology Co.,Ltd. (CN) 2026-05-26 CN claimed
CN-122094307-A Photoelectric device 2026-05-26 CN claimed
US-12641802-B2 Liner to form composite high-K dielectric APPLIED MATERIALS, INC. (US) 2026-05-26 US claimed
CN-117623877-B Cardanol bisphenol and preparation method and application thereof CHANGSHU NAISU BIOLOGICAL MATERIAL TECHNOLOGY CO.,LTD. (CN) 2026-05-26 CN claimed
US-3943227-A Polyolefin composition and use of same in alkaline solutions EXXON RESEARCH & ENGINEERING CO. (US) 1976-03-09 US claimed
US-3943186-A Method for producing isopentene UBE INDUSTRIES, LTD. (JA) 1976-03-09 US claimed
US-3941770-A Method for purifying 3',5'-cyclic-adenylic acid or 3',5'-cyclic-deoxyadenylic acid KIKKOMAN SHOYU CO., LTD. (JA) 1976-03-02 US claimed
US-3941846-A Preparation of nitrocarbonyl compounds TEXACO INC. (US) 1976-03-02 US claimed
US-3935100-A Process for the treatment of waste waters containing sulfuric acid and/or ammonium sulfate INSTITUT FRANCAIS DU PETROLE (FR) 1976-01-27 US claimed
US-3932511-A Preparation of cyclohexane-1,3-dione and of alkyl-substituted derivatives thereof STAMICARBON B.V. (NL) 1976-01-13 US claimed
US-3931053-A NICKEL, ALUMINUM, MAGNESIUM, CALCIUM, BARIUM OXIDES KAZAKOV EVGENY VASILIEVICH 1976-01-06 US claimed
US-3930984-A COAL-ANTHRACENE OIL SLURRY LIQUEFIED WITH CARBON MONOXIDE AND BARIUM-PROMOTED CATALYSTS PHILLIPS PETROLEUM COMPANY (US) 1976-01-06 US claimed
US-3931050-A PLATINUM-METAL OXIDE NIPPON SOKEN, INC. (JA) 1976-01-06 US claimed
US-3930873-A INORGANIC SILVER COMPOUND, METAL FLUORIDE ERNST LEITZ G.M.B.H. (DT) 1976-01-06 US claimed