Water

Water

SCHEMBL25155

O.O.O.O.O.O.[Ca+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 SCHEMBL28983952 1.00
Water SCHEMBL11161032 1.00
Water SCHEMBL8360061 1.00
Water SCHEMBL527906 1.00
Water SCHEMBL51574 1.00
Water SCHEMBL722694 1.00
Water SCHEMBL17794 1.00
Water SCHEMBL1668761 1.00
Water SCHEMBL24369 1.00
Water SCHEMBL28681484 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

Appears in 4586 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-121574829-B Acanthamoeba for inhibiting fusarium graminearum and application thereof Sanya Research Institute of Nanjing Agricultural University (CN) 2026-05-26 CN claimed
CN-122080864-A Packaging and forming method of inorganic solid-liquid phase-change material 2026-05-26 CN claimed
CN-122071624-A Composite phase-change heat storage material and preparation method thereof 国能榆林能源有限责任公司 2026-05-22 CN claimed
CN-122037299-A Preparation method and application of temperature-regulating foam with bionic structure 江南大学 2026-05-15 CN claimed
CN-122011746-A Aerogel heat-sealing film based on phase change material blending and thermal runaway inhibition method thereof 深圳鑫富艺科技股份有限公司 2026-05-12 CN claimed
US-20260125591-A1 INORGANIC LATENT HEAT STORAGE MATERIAL COMPOSITION AND USE THEREOF KANEKA CORPORATION (JP) 2026-05-07 US claimed
US-12618058-B2 Blends containing proteases ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2026-05-05 US claimed
US-20260115038-A1 COOLING PAD AND METHODS OF MAKING AND USING THE SAME EZTIA CORP. (US) 2026-04-30 US claimed
US-20260109648-A1 ACTIVE AND PASSIVE INTEGRATED FIREPROOF HEAT-INSULATING BOARD AND PREPARATION METHOD THEREOF China State Construction Hailong Technology Company Limited (CN) 2026-04-23 US claimed
US-12570141-B2 Vehicle fuel storage system including bladder PLASTIC OMNIUM ADVANCED INNOVATION AND RESEARCH (BE) 2026-03-10 US claimed
EP-0034164-A1 A METHOD AND APPARATUS FOR STORING HEAT. CARLSSON BO (SE) 1981-08-26 EP claimed
US-4273667-A Thermal energy storage material comprising hydrated compound and water-swollen cross-linked polymer THE CALOR GROUP LIMITED 1981-06-16 US claimed
WO-1981000574-A1 A METHOD AND APPARATUS FOR STORING HEAT CARLSSON B (SE) 1981-03-05 WO claimed
EP-0011357-A1 The use of a collocation containing hydrates to store heat at a steady temperature, and a heat storage device containing this collocation NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1980-05-28 EP claimed
US-4189394-A Heat storage material comprising calcium chloride-hexahydrate and a nucleating agent U.S. PHILIPS CORPORATION (US) 1980-02-19 US claimed
US-4187189-A Phase change thermal storage materials with crust forming stabilizers AMERICAN TECHNOLOGICAL UNIVERSITY (US) 1980-02-05 US claimed
EP-0005362-A1 Heat exchange bodies utilizing heat of fusion effects and methods of making same AMERICAN TECHNOLOGICAL UNIVERSITY (US) 1979-11-14 EP claimed
US-4037650-A Thermal storage apparatus NATIONAL RESEARCH DEVELOPMENT CORPORATION (EN) 1977-07-26 US claimed
US-4020210-A Encapsulated water paper XEROX CORPORATION (US) 1977-04-26 US claimed
US-3996351-A Process for orally increasing the blood calcium level of animals BAUER KLAUS 1976-12-07 US claimed