Water

Water

SCHEMBL489585

O.O.O.[Fe].[Fe].[Ti]

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 SCHEMBL758422 1.00
Water SCHEMBL1161816 1.00
Water SCHEMBL27689251 1.00
Water SCHEMBL19467299 0.87
Water SCHEMBL30377395 0.87
Water SCHEMBL28186165 0.87
Water SCHEMBL31182206 0.87
Water SCHEMBL30959700 0.87
Water SCHEMBL9317662 0.82
Water SCHEMBL21277 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 54 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115515898-A Improved aerogel compositions and methods 斯攀气凝胶公司 2022-12-23 CN claimed
EP-3360853-B9 COMPOSITION OF GREEN UV-ABSORBENT GLASS FOR SOLAR CONTROL VIDRIO PLANO MEXICO SA DE CV (MX) 2026-02-18 EP disclosed
EP-3360853-B1 COMPOSITION OF GREEN UV-ABSORBENT GLASS FOR SOLAR CONTROL VIDRIO PLANO MEXICO SA DE CV (MX) 2025-12-03 EP disclosed
WO-2024237268-A1 METHOD FOR PRODUCING COMPOSITE PARTICLES 信越化学工業株式会社 2024-11-21 WO disclosed
CN-221963071-U Strip-shaped product with heating function 株式会社爱茉莉太平洋 2024-11-08 CN disclosed
CN-118542818-A Water-in-oil type solid emulsion cosmetic 东色颜料有限公司 2024-08-27 CN disclosed
CN-117617667-A Strip-shaped product with heating function 株式会社爱茉莉太平洋 2024-03-01 CN disclosed
CN-115590784-B Permanent cosmetic composition 美尚(广州)化妆品股份有限公司 2024-02-20 CN disclosed
EP-3527194-B1 COMPOSITE PARTICLES INCLUDING ANIONIC POLYMER AND CATIONIC POLYMER OR PEPTIDE, AND METHOD FOR PRODUCING COMPOSITE PARTICLES POLA CHEM IND INC (JP) 2024-02-14 EP disclosed
CN-115192468-B Composite particles comprising anionic polymer and cationic polymer or peptide, and method for producing same 宝丽化学工业有限公司 2024-02-13 CN disclosed
US-8105691-B2 Hydrophilized surface-treated powder and cosmetics containing same MIYOSHI KASEI, INC. (JP) 2012-01-31 US disclosed
WO-2011136389-A2 COSMETIC AND TOPICAL SKIN PREPARATION COMPRISING HIGHER ALCOHOL-MODIFIED SILICONE DOW CORNING TORAY CO., LTD. (JP) 2011-11-03 WO disclosed
WO-2011078395-A2 THICKENER OR GELLANT FOR OIL MATERIALS, GEL COMPOSITION COMPRISING SAME, AND METHOD OF PRODUCING COSMETIC MATERIAL OR TOPICAL AGENT DOW CORNING TORAY CO., LTD. (JP) 2011-06-30 WO disclosed
US-20100239680-A1 Powder Cosmetic Composition SHISEIDO COMPANY, LTD. (JP) 2010-09-23 US disclosed
US-20100129412-A1 BRIGHT PIGMENT AND COSMETIC COMPOSITION USING THE SAME NIPPON SHEET GLASS COMPANY, LIMITED (JP) 2010-05-27 US disclosed
EP-2147954-A1 PHOTOLUMINESCENT PIGMENT AND COSMETIC COMPOSITION USING THE SAME Nippon Sheet Glass Company, Limited (JP) 2010-01-27 EP disclosed
US-20090263660-A1 SURFACE-TREATED POWDER AND COSMETICS CONTAINING SAME MIYOSHI KASEI, INC. (JP) 2009-10-22 US disclosed
EP-2044924-A1 POWDERY COSMETIC Shiseido Company, Limited (JP) 2009-04-08 EP disclosed
EP-1914264-A1 SURFACE-TREATED POWDER AND COSMETIC COMPRISING THE SAME Miyoshi Kasei, Inc. (JP) 2008-04-23 EP disclosed
US-4790881-A CELLULOSE DERIVATIVES, POLYVINYLPYRROLIDINE, GUM ARABIC; CAPSULES WARNER-LAMBERT COMPANY (US) 1988-12-13 US disclosed