Water

Water

SCHEMBL225664

O.[Cl-].[Cl-].[Ni+2]

nearest known ligand 0.00

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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 SCHEMBL4957698 1.00
Water SCHEMBL2295403 1.00 KDM3A (0.33)
Water SCHEMBL9317506 1.00 KDM3A (0.33)
Water SCHEMBL7546680 1.00
Water SCHEMBL6343678 1.00
Water SCHEMBL6308023 1.00
Water SCHEMBL117189 1.00
Water SCHEMBL2708008 1.00 KDM3A (0.33)
Water SCHEMBL1552649 1.00
Water SCHEMBL28312514 0.87

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122082009-A IrO for PEM electrolyzed water2@NiRuOxAnode catalyst, preparation method and application thereof 2026-05-26 CN claimed
CN-122067922-A Porous electrode material, preparation method thereof and capacitor 深圳市力容电子有限公司 2026-05-19 CN claimed
EP-4691998-A1 METHOD FOR PRODUCING METAL OXIDE NANOPARTICLES, METAL OXIDE NANOPARTICLES, INK COMPOSITION COMPRISING SAME, LIGHT-EMITTING ELEMENT, ELECTRONIC DEVICE, AND ELECTRONIC APPLIANCE Samsung Display Co., Ltd. (KR) 2026-02-11 EP claimed
CN-118996555-B Method for improving corrosion resistance of resistance copper foil 浙江花园新能源股份有限公司 2025-06-24 CN claimed
CN-119446800-B Sulfur-doped nickel-manganese layered double hydroxide electrode material, preparation method and capacitor 西安理工大学 2025-04-04 CN claimed
CN-119144033-B Infrared stealth film material of functional polystyrene and preparation method thereof 黄山天之都环境科技发展有限公司 2025-02-18 CN claimed
CN-119446800-A Sulfur-doped nickel-manganese layered double hydroxide electrode material, preparation method and capacitor 西安理工大学 2025-02-14 CN claimed
CN-119215930-A FeCoNiMnRu high-entropy alloy catalyst and preparation method and application thereof 桂林电子科技大学 2024-12-31 CN claimed
CN-119153666-A Positive electrode material and preparation method and application thereof 蜂巢能源科技股份有限公司 2024-12-17 CN claimed
CN-119144033-A Infrared stealth film material of functional polystyrene and preparation method thereof 黄山天之都环境科技发展有限公司 2024-12-17 CN claimed
WO-2007140525-A1 A METHOD OF TREATMENT AND PROPHYLAXIS OF EVENTS, CONDITIONS AND DISEASES OF THE SYSTEMIC VASCULATURE AN IMMUNE FUNCTION TO DECREASE CARDIOVASCULAR RISK AND PATHOGENIC INFECTION HOENIG MICHEL (AU) 2007-12-13 WO claimed
EP-1604954-A1 Process for the production of anhydrous nickel chloride E.I. du Pont de Nemours and Company (US) 2005-12-14 EP claimed
WO-2005102043-A2 USE OF NICKEL TO CORRECT GROWTH DISORDERS IN PLANTS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2005-11-03 WO claimed
US-20050245397-A1 Use of nickel to correct growth disorders in plants NIPAN, LLC 2005-11-03 US claimed
US-6893996-B2 Process for the preparation of a nickel/phosphorous ligand catalyst for olefin hydrocyanation INVISTA NORTH AMERICA S.A.R.L. (US) 2005-05-17 US claimed
EP-1450949-A2 PROCESS FOR THE PREPARATION OF A NICKEL/PHOSPHORUS LIGAND CATALYST FOR OLEFIN HYDROCYANATION E. I. du Pont de Nemours and Company (US) 2004-09-01 EP claimed
WO-2003045555-A2 PROCESS FOR THE PREPARATION OF A NICKEL/PHOSPHORUS LIGAND CATALYST FOR OLEFIN HYDROCYANATION E. I. DU PONT DE NEMOURS AND COMPANY (US) 2003-06-05 WO claimed
US-20030100442-A1 Process for the preparation of a nickel/phosphorous ligand catalyst for olefin hydrocyanation INVISTA NORTH AMERICA S.A.R.L. 2003-05-29 US claimed
US-6337038-B1 Particles of a window for varying the degree of light transmission in presence of electric field and uses thereof KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2002-01-08 US claimed
US-3946057-A ALKYLENE OXIDE, METAL HALIDE, POLAR SOLVENT UNION CARBIDE CORPORATION (US) 1976-03-23 US claimed