Water

Water

SCHEMBL3772662

O.[F-].[F-].[Mg+2]

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 SCHEMBL147648 1.00
Fluoride SCHEMBL27327368 0.87
Water SCHEMBL29031494 0.87
Water SCHEMBL9396493 0.82
Water SCHEMBL9070293 0.82
Water SCHEMBL7798090 0.82
Fluoride Ion SCHEMBL4746079 0.82
Fluoride Ion SCHEMBL24361 0.82
Fluoride Ion SCHEMBL5392118 0.82
Water SCHEMBL9550839 0.82

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113562986-A Optical glass coating and strengthening method 苏州光大光电科技有限公司 2021-10-29 CN claimed
CN-107106736-B Magnesium alloy for protection of bioabsorbable stents 美敦力瓦斯科尔勒公司 2020-08-04 CN claimed
US-6713170-B1 HEAT OR UV-CURABLE; TRANSPARENT; LOW REFRACTIVE, ANTIREFLECTION; (METH)ACRYLOYL POLYMER, SILICA AND MAGNESIUM FLUORIDE HYDRATE COLLOID PARTICLES NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2004-03-30 US claimed
CN-1329644-A Hard coating material and film obtained with the same NIPPON KAYAKU KK (JP) 2002-01-02 CN claimed
EP-1146093-A1 HARD COATING MATERIAL AND FILM OBTAINED WITH THE SAME NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2001-10-17 EP claimed
JP-7069621-A None JP disclosed
JP-7069621-A None JP disclosed
WO-2024154575-A1 CORROSION-RESISTANT MEMBER 株式会社レゾナック 2024-07-25 WO disclosed
US-11859288-B2 Corrosion-resistant member RESONAC CORPORATION (JP) 2024-01-02 US disclosed
CN-113891960-B Corrosion resistant member 株式会社力森诺科 2023-12-08 CN disclosed
EP-4043613-A1 CORROSION-RESISTANT MEMBER Showa Denko K.K. (JP) 2022-08-17 EP disclosed
US-20220251699-A1 CORROSION-RESISTANT MEMBER SHOWA DENKO K.K. (JP) 2022-08-11 US disclosed
EP-1008555-B1 Silica-magnesium fluoride hydrate composite sols and process for their preparation NISSAN CHEMICAL IND LTD (JP) 2004-03-03 EP disclosed
CN-1329644-A Hard coating material and film obtained with the same NIPPON KAYAKU KK (JP) 2002-01-02 CN disclosed
EP-1146093-A1 HARD COATING MATERIAL AND FILM OBTAINED WITH THE SAME NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2001-10-17 EP disclosed
US-6291535-B1 Silica-magnesium fluoride hydrate composite sols and process for their preparation NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2001-09-18 US disclosed
JP-2000169133-A COMBINED SOL OF SILICA-MAGNESIUM FLUORIDE HYDRATE AND ITS PRODUCTION NISSAN CHEM IND LTD 2000-06-20 JP disclosed
EP-1008555-A1 Silica-magnesium fluoride hydrate composite sols and process for their preparation NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 2000-06-14 EP disclosed
JP-H0769621-A MAGNESIUM FLUORIDE HYDRATE SOL AND PRODUCTION THEREOF NISSAN CHEM IND LTD 1995-03-14 JP disclosed
JP-H0769621-A MAGNESIUM FLUORIDE HYDRATE SOL AND PRODUCTION THEREOF NISSAN CHEM IND LTD 1995-03-14 JP disclosed