Water

Water

SCHEMBL50183

O.[Cl-].[Cl-].[Mg+2]

nearest known ligand 0.00

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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 SCHEMBL28154778 1.00
Water SCHEMBL28617541 1.00
Water SCHEMBL27139545 1.00
Water SCHEMBL28572506 1.00
Water SCHEMBL8515735 1.00
Water SCHEMBL2178451 1.00
Water SCHEMBL1051679 1.00
Water SCHEMBL11417389 1.00
Water SCHEMBL139170 1.00
Water SCHEMBL27991690 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 2987 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122070325-A Vulcanizable rubber composition free of metal-containing accelerator and vulcanizate thereof 株式会社普利司通 2026-05-19 CN claimed
US-12629555-B2 Long-term fire retardant with magnesium sulfate and corrosion inhibitors and methods for making and using same PERIMETER SOLUTIONS, LP (US) 2026-05-19 US claimed
US-20260132041-A1 MAGNESIUM CHLORIDE PURIFICATION SYSTEMS, DEVICES AND METHODS MAGRATHEA METALS INC (US) 2026-05-14 US claimed
EP-4717726-A1 ADHESION CONTROL OF HYDROGEL Daegu Gyeongbuk Institute of Science and Technology (KR) 2026-04-01 EP claimed
US-20260070017-A1 HYDROXYCHLORIDE SALT OCEAN ALKALINITY ENHANCEMENT MAGRATHEA METALS INC (US) 2026-03-12 US claimed
CN-121575246-A Method for removing zinc by smelting magnesium through silicothermic process 西安交通大学 2026-02-27 CN claimed
US-20260014404-A1 LONG-TERM FIRE RETARDANT WITH CORROSION INHIBITORS AND METHODS FOR MAKING AND USING SAME PERIMETER SOLUTIONS, LP (US) 2026-01-15 US claimed
US-12473576-B2 Thermal decomposition of magnesium chloride PURAC BIOCHEM BV (NL) 2025-11-18 US claimed
EP-4598874-A2 MAGNESIUM CHLORIDE PURIFICATION SYSTEMS, DEVICES AND METHODS Magrathea Metals Inc. (US) 2025-08-13 EP claimed
CN-120057970-A Calcium ammonium nitrate granule and granulating method 杭州昇洋科技有限公司 2025-05-30 CN claimed
US-4183362-A Decreasing the burn rate of smoking tobaccos LIGGETT GROUP INC. (US) 1980-01-15 US claimed
US-4177205-A QUENCHING CARBODIIMIDE FORMATION WITH MGANESIUM CHLORIDE, STANNOUS CHLORIDE, OR TRICHLOROSILANE BASF WYANDOTTE CORPORATION (US) 1979-12-04 US claimed
US-4174228-A SPRAYABLE FIREPROOFING MATERIAL PPG INDUSTRIES, INC. (US) 1979-11-13 US claimed
US-4174229-A SPRAYABLE FIREPROOFING MATERIAL PPG INDUSTRIES, INC. (US) 1979-11-13 US claimed
US-4162297-A Recovery of magnesium chloride from brines MINES DE POTASSE D'ALSACE S.A. (FR) 1979-07-24 US claimed
US-4111835-A CATALYSTS FOR POLYMERIZING OLEFINS TO SPHEROIDAL-FORM POLYMERS MONTEDISON S.P.A. (IT) 1978-09-05 US claimed
US-4056599-A Process for the recovery of magnesium chloride hydrate and potassium chloride from carnallite and bischofite BECHTEL INTERNATIONAL CORPORATION (US) 1977-11-01 US claimed
US-3983224-A Anhydrous magnesium chloride process NALCO CHEMICAL COMPANY (US) 1976-09-28 US claimed
US-3966888-A Anhydrous magnesium chloride using ethylene glycol and ammonia NALCO CHEMICAL COMPANY (US) 1976-06-29 US claimed
US-3962408-A Dehydration of magnesium chloride THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE INTERIOR (US) 1976-06-08 US claimed