Water

Water

SCHEMBL570871

O.O.O.O.O.O.[CaH2]

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 SCHEMBL9489446 1.00
Water SCHEMBL457728 1.00
Water SCHEMBL9136338 1.00
Water SCHEMBL8332252 1.00
Water SCHEMBL5193902 1.00
Water SCHEMBL486758 1.00
Water SCHEMBL409681 1.00
Water SCHEMBL5595444 1.00
Water SCHEMBL8664030 1.00
Water SCHEMBL10626151 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 111 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240337395-A1 Ductwork System for Modulating Conditioned Air ALDERMAN ROBERT J (US) 2024-10-10 US claimed
WO-2024008858-A1 VEHICLE FUEL STORAGE SYSTEM INCLUDING BLADDER PLASTIC OMNIUM ADVANCED INNOVATION AND RESEARCH (BE) 2024-01-11 WO claimed
WO-2023203117-A1 VEHICLE FUEL STORAGE SYSTEM INCLUDING BLADDER PLASTIC OMNIUM ADVANCED INNOVATION AND RESEARCH (BE) 2023-10-26 WO claimed
EP-4067455-B1 HEAT STORAGE MATERIAL COMPOSITION, AND HEAT STORAGE SYSTEM FOR HEATING AND COOLING BUILDING YAZAKI CORP (JP) 2023-09-20 EP claimed
EP-3405179-B1 CONTROL OF THE RELEASE OF WATER FROM A SOLID COMPOSITION CONTAINING WATER LTS LOHMANN THERAPIE SYSTEME AG (DE) 2023-08-09 EP claimed
US-20220034547-A1 Ductwork System for Modulating Conditioned Air ALDERMAN ROBERT J (US) 2022-02-03 US claimed
EP-3409783-B1 INVENTION RELATING TO DETECTION AND QUANTIFICATION OF COLISTIN RESISTANCE IN GRAM-POSITIVE BACTERIA UNIV JUSTUS LIEBIG GIESSEN (DE) 2020-12-16 EP claimed
EP-2671038-B1 LATENT HEAT STORAGE DEVICE PROMAT GMBH (DE) 2016-05-04 EP claimed
EP-2870255-B1 PREPARATION OF SODIUM HYALURONATE USING A MUTANT OF STREPTOCOCCUS ZOOEPIDEMICUS ALTERGON ITALIA S R L (IT) 2016-04-06 EP claimed
EP-2616534-B1 DEVICE FOR CONTROLLING THE TEMPERATURE OF A DIRECT-ILLUMINATION SOLAR PHOTOBIOREACTOR UNIV NANTES (FR) 2016-01-20 EP claimed
EP-0969964-B1 A THERMAL CONTROL DEVICE HAYES CLAUDE Q C (US) 2004-09-29 EP claimed
EP-0689024-B1 Heat accumulator TOYOTA MOTOR CO LTD (JP) 1999-02-10 EP claimed
EP-0195723-B1 PROCESS AND DEVICE FOR CONDITIONING LOW AND MIDDLE LEVEL RADIOACTIVE WASTE SOLUTIONS WITH HYDRAULIC BINDERS SOCIETE GENERALE POUR LES TECHNIQUES NOUVELLES S.G.N. Société anonyme dite: (FR) 1989-08-02 EP claimed
EP-0176119-B1 COMPOSITION BASED ON HEXAHYDRATED CALCIUM CHLORIDE FOR STORING CALORIES BY PHASE CHANGE, AND PROCESS FOR ITS PREPARATION SOLVAY & Cie (Société Anonyme) (BE) 1988-06-08 EP claimed
EP-0079836-B1 COMPOSITIONS BASED ON WATER-SOLUBLE GUMS, THEIR PREPARATION AND THEIR USE RHONE-POULENC CHIMIE (FR) 1987-01-21 EP claimed
EP-0195723-A1 Process and device for conditioning low and middle level radioactive waste solutions with hydraulic binders SOCIETE GENERALE POUR LES TECHNIQUES NOUVELLES S.G.N. Société anonyme dite: (FR) 1986-09-24 EP claimed
EP-0176119-A1 Composition based on hexahydrated calcium chloride for storing calories by phase change, and process for its preparation SOLVAY & Cie (Société Anonyme) (BE) 1986-04-02 EP claimed
EP-0070729-B1 HEAT ACCUMULATING MATERIAL MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1985-03-20 EP claimed
US-4482010-A Method and apparatus for storing energy CORDON WILLIAM A 1984-11-13 US claimed
EP-0079836-A1 Compositions based on water-soluble gums, their preparation and their use RHONE-POULENC CHIMIE (FR) 1983-05-25 EP claimed