Water

Water

SCHEMBL248737

O.O.O.O.O.O.O.O.O=[Zr+2].[Cl-].[Cl-]

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 SCHEMBL17923378 1.00
Water SCHEMBL8143385 1.00
Water SCHEMBL234686 1.00
Water SCHEMBL7523099 1.00
Water SCHEMBL9116135 1.00
Water SCHEMBL9447329 1.00
Hydrochloric Acid SCHEMBL191166 0.89
Hydrochloric Acid SCHEMBL2369365 0.89
Hydrochloric Acid SCHEMBL10937409 0.89
Hydrochloric Acid SCHEMBL7559882 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122057522-A Nickel-based catalyst based on bi-metal solid solution oxide as carrier, preparation method and application thereof in hydrogen production 吉林大学 2026-05-19 CN claimed
EP-4614598-A1 NEGATIVE ELECTRODE MATERIAL AND PREPARATION METHOD THEREFOR, AND LITHIUM-ION BATTERY BTR New Material Group Co., Ltd. (CN) 2025-09-10 EP claimed
CN-117659430-B Layered metal organic framework material, preparation method and application 北京工业大学 2025-06-17 CN claimed
CN-119246201-A Analysis and detection method for serum metabolites and application thereof 上海道谱盛科技有限公司 2025-01-03 CN claimed
CN-119016038-A Cationic MOFs material and preparation method and application thereof 北京化工大学 2024-11-26 CN claimed
CN-118389402-A Serum-free medium for efficiently expressing erythropoietin by CHO cells 深圳赛保尔生物药业有限公司 2024-07-26 CN claimed
CN-115487832-B Catalyst for low-temperature propane oxidation and preparation method thereof 华东理工大学 2024-04-02 CN claimed
CN-117659430-A Layered metal organic framework material, preparation method and application 北京工业大学 2024-03-08 CN claimed
US-11923548-B2 Electro catalyst composition with redox buffer metal oxides for bi-functional air electrode INDIAN OIL CORPORATION LIMITED (IN) 2024-03-05 US claimed
US-11884639-B2 Preparation method for high optical indoxacarb intermediate SHANDONG JINGBO AGROCHEMICALS TECHNOLOGY CO., LTD. (CN) 2024-01-30 US claimed
US-6956064-B2 Catalyst composition comprising ruthenium and zirconium and processes therefor and therewith for preparing high molecular weight hydrocarbons such as polymethylene CONOCOPHILLIPS COMPANY (US) 2005-10-18 US claimed
US-20040191162-A1 Method for processing a zirconium oxide composition in crystalline form BAXTER HEALTHCARE S.A. (CH) 2004-09-30 US claimed
US-20040127584-A1 Chemical vapor deposition synthesis of polymerization catalyst composition PHILLIPS PETROLEUM COMPANY 2004-07-01 US claimed
US-20040127583-A1 Catalyst composition comprising ruthenium and zirconium and processes therefor and therewith for preparing high molecular weight hydrocarbons such as polymethylene PHILLIPS PETROLEUM COMPANY 2004-07-01 US claimed
EP-0757014-B1 Process for the preparation of mixed silica-zirconia sols and mixed oxides obtained in spherical form ENICHEM SPA (IT) 2002-03-13 EP claimed
US-6114269-A HEATING IN AQUEOUS SOLUTION OF SODIUM CHLORIDE THEREBY REPLACING EXCHANGEABLE IONS IN THE MICA WITH SODIUM TEXAS A&M UNIVERSITY SYSTEM, THE 2000-09-05 US claimed
US-5780004-A MIXING A SILICON ALKOXIDE WITH A SOLUTION OF AN INORGANIC ZIRCONIUM SALT IN A LOW MOLECULAR WEIGHT POLYOL; ACID HYDROLYSIS; CALCINING ENICHEM S.P.A. (IT) 1998-07-14 US claimed
EP-0757014-A1 Process for the preparation of mixed silica-zirconia sols and mixed oxides obtained in spherical form ENICHEM S.p.A. (IT) 1997-02-05 EP claimed
EP-0520543-A1 Superacidic catalyst and process for preparing it ENIRICERCHE S.p.A. (IT) 1992-12-30 EP claimed
US-4855059-A Purification of brines with hydrous metal oxide ion exchangers LITHIUM CORPORATION OF AMERICA (US) 1989-08-08 US claimed