Water

Water

SCHEMBL17794

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 SCHEMBL25155 1.00
Water SCHEMBL722694 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 21732 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122081068-A Lignin degrading microorganism and separation method and application thereof 2026-05-26 CN claimed
CN-122080466-A Tough cellulose nanofiber-based composite film with optimized bionic interface and preparation method thereof 2026-05-26 CN claimed
CN-122079523-A Solid waste-based expansion active agent and preparation method thereof 2026-05-26 CN claimed
CN-121796301-B Composition for relieving and repairing and promoting skin regeneration, and preparation method and application thereof Kelan (Chongqing) Biomedical Technology Co.,Ltd. (CN) 2026-05-26 CN claimed
CN-122079360-A Method for degrading nicotine 2026-05-26 CN claimed
CN-122061306-A Processing method of high-strength bamboo fiber non-woven fabric 张毅 2026-05-19 CN claimed
CN-122059544-A Method for degrading chloramphenicol by using Chlamydomonas reinhardtii-isoleucine metabolic system 山东正元环境科技有限公司 2026-05-19 CN claimed
CN-120794192-B Use of Cladophialophora psammophila in degrading grease 贵州医科大学 2026-05-15 CN claimed
CN-122038491-A Application of phoxim in improving yield of organic acid produced by fermentation of filamentous fungi 南京师范大学 2026-05-15 CN claimed
CN-122031770-A Bone repair material obtained by using soft-shelled turtle scale collagen as biomineralization template and preparation method thereof 武汉理工大学 2026-05-15 CN claimed
US-4673519-A Low-energy process for the manufacture of calcium/magnesium acetate-chloride deicers and freezing point depressants GANCY ALAN B 1987-06-16 US claimed
US-4654341-A ALKALI METAL DICHLOROISOCYANURATE, CALCIUM OR BARIUM CHLORIDE, SUSTAINED RELEASE MONSANTO COMPANY (US) 1987-03-31 US claimed
EP-0214531-A2 Method for the recovery of extracellular enzymes from whole fermentation beer SOLVAY ENZYMES, INC. (a Delaware corporation) (US) 1987-03-18 EP claimed
US-4610873-A Composition and method for making a clear aqueous solution free of calcium phosphate crystals CARIES RESEARCH GROUP OF ROCHESTER, INC. (US) 1986-09-09 US claimed
US-4348372-A Process for the recovery of calcium chloride from calcium hypochlorite process effluents OLIN CORPORATION (US) 1982-09-07 US claimed
US-4348371-A Process for the recovery of calcium salts from calcium hypochlorite process effluents OLIN CORPORATION (US) 1982-09-07 US claimed
EP-0003429-B1 PRODUCTION OF ALKALI METAL CHLORIDES LONRHO LIMITED (GB) 1982-06-09 EP claimed
US-4107300-A SULFUR CONTAINING COMPOUNDS, CALCIUM CHLORIDE SANKYO COMPANY LIMITED (JP) 1978-08-15 US claimed
US-4076776-A Calcium chloride prilling THE DOW CHEMICAL COMPANY (US) 1978-02-28 US claimed
US-3937821-A GLUCOSE KYORIN SEIYAKU KABUSHIKI KAISHA (JA) 1976-02-10 US claimed