Water

Water

SCHEMBL797313

O.O.O.O.[KH]

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 SCHEMBL9484116 1.00
Water SCHEMBL8369534 1.00
Water SCHEMBL1504321 1.00
Water SCHEMBL3820520 1.00
Water SCHEMBL8466165 1.00
Water SCHEMBL22588912 1.00
Water SCHEMBL1530181 1.00
Water SCHEMBL8193216 1.00
Water SCHEMBL6228132 1.00
Water SCHEMBL3819207 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

Claimed or disclosed in 69 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230279553-A1 Method for Manufacturing Conductive Pattern-Provided Structure ASAHI KASEI KABUSHIKI KAISHA (JP) 2023-09-07 US claimed
EP-4234758-A1 METHOD FOR MANUFACTURING CONDUCTIVE PATTERN-PROVIDED STRUCTURE Asahi Kasei Kabushiki Kaisha (JP) 2023-08-30 EP claimed
EP-3169709-B1 CRYSTALLINE ANTIBODY FORMULATIONS AMGEN INC (US) 2021-05-12 EP claimed
EP-2455339-B1 MAGNESIUM OXIDE PARTICLES, METHOD FOR PRODUCING SAME, HEAT DISSIPATING FILLER, RESIN COMPOSITION, HEAT DISSIPATING GREASE, AND HEAT DISSIPATING COATING COMPOSITION SAKAI CHEMICAL INDUSTRY CO (JP) 2017-01-04 EP claimed
EP-2278997-B1 NANOEMULSION INFLUENZA VACCINE NANOBIO CORP (US) 2016-08-10 EP claimed
EP-1334078-B1 FERTILIZER WOLF TRAX INC (CA) 2011-07-20 EP claimed
EP-1918320-B1 FLAME RETARDANT POLYMER COMPOSITIONS HUNTSMAN ADV MAT SWITZERLAND (CH) 2009-12-09 EP claimed
EP-1478339-B9 PHARMACEUTICAL FORMULATIONS OF ANTINEOPLASTIC AGENTS, IN PARTICULAR TEMOZOLOMIDE, PROCESSES OF MAKING AND USING THE SAME SCHERING CORP (US) 2009-08-19 EP claimed
EP-1576041-B1 FLAME RETARDANT POLYMER COMPOSITIONS HUNTSMAN ADV MAT SWITZERLAND (CH) 2008-10-22 EP claimed
EP-1478339-B1 PHARMACEUTICAL FORMULATIONS OF ANTINEOPLASTIC AGENTS, IN PARTICULAR TEMOZOLOMIDE, PROCESSES OF MAKING AND USING THE SAME SCHERING CORP (US) 2008-06-04 EP claimed
EP-1310456-B1 Process for the production of potassium octoborate tetrahydrate and its use in the agronomic field LARDERELLO SPA (IT) 2006-10-11 EP claimed
EP-0323096-B2 Production of articles of bonded particulate material and binder compostions for use therein FOSECO INT (GB) 1999-02-24 EP claimed
CN-122055264-A Laminate body 旭化成株式会社 2026-05-15 CN disclosed
US-20240139105-A1 PHARMACEUTICAL COMPOSITION CONTAINING GHRP-6 CT INGENIERIA GENETICA BIOTECNOLOGIA (CU) 2024-05-02 US disclosed
EP-4285891-A1 PHARMACEUTICAL COMPOSITION CONTAINING GHRP-6 Centro de Ingeniería Genética y Biotecnología (CU) 2023-12-06 EP disclosed
US-20230279553-A1 Method for Manufacturing Conductive Pattern-Provided Structure ASAHI KASEI KABUSHIKI KAISHA (JP) 2023-09-07 US disclosed
EP-0811044-B1 BORON-CONTAINING AQUEOUS SOLUTION PARTICULARLY FOR ADDITION TO AMYLOID GLUE DEV ACTIVITES CHIMIQUES DISTRI (FR) 2000-09-20 EP disclosed
WO-1999061899-A1 AUTOMATIC DEVICE FOR IMPLEMENTING A METHOD DETERMINING NITROGEN TRICHLORIDE IN CHLORINE AND AMMONIA ION IN BRINES ELF ATOCHEM S.A. (FR) 1999-12-02 WO disclosed
EP-0811044-A1 BORON-CONTAINING AQUEOUS SOLUTION PARTICULARLY FOR ADDITION TO AMYLOID GLUE Developpement, Activites Chimiques Distribution (FR) 1997-12-10 EP disclosed
WO-1996026252-A1 BORON-CONTAINING AQUEOUS SOLUTION PARTICULARLY FOR ADDITION TO AMYLOID GLUE DEVELOPPEMENT, ACTIVITES CHIMIQUES DISTRIBUTION (FR) 1996-08-29 WO disclosed