Water

Water

SCHEMBL6038352

O.O.O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Mg+2]

nearest known ligand 0.67

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.

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 known ✓ O00255 1/20 0.67
KMT2A Q03164 1/20 0.67
CA5A P35218 1/20 0.46
CA5B Q9Y2D0 1/20 0.46
TSHR P16473 3/20 0.39
ALDH1A1 P00352 3/20 0.39
TDP1 Q9NUW8 1/20 0.39
HPGD P15428 1/20 0.36
HIF1A Q16665 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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 SCHEMBL219368 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL6346899 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL6221351 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL28315089 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL94658 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL16334813 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL4176811 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL8961675 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL1982246 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL9755739 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250257291-A1 PARTICULATE LAUNDRY SCENT ADDITIVE COMPRISING A PERFUME/WATER-SOLUBLE POLYMER/SALT HYDRATE MATRIX PROCTER & GAMBLE (US) 2025-08-14 US claimed
US-12312567-B2 Particulate laundry scent additive comprising a polyethylene glycol/ethoxylated alcohol polymer composition THE PROCTER & GAMBLE COMPANY (US) 2025-05-27 US claimed
US-20240251721-A1 ADDITIVE FOR MUSHROOM GROWTH MEDIUM SETOLAS HOLDINGS, INC. (JP) 2024-08-01 US claimed
US-12010954-B2 Additive for mushroom growth medium SETOLAS HOLDINGS, INC. (JP) 2024-06-18 US claimed
EP-3864106-B1 METAL NITRATE BASED COMPOSITIONS FOR USE AS PHASE CHANGE MATERIALS SUNAMP LTD (GB) 2024-04-03 EP claimed
US-11891561-B2 Metal nitrate based compositions for use as phase change materials SUNAMP LIMITED (GB) 2024-02-06 US claimed
US-20230054402-A1 PARTICULATE LAUNDRY SCENT ADDITIVE THE PROCTER & GAMBLE COMPANY 2023-02-23 US claimed
CN-115476504-A Additive manufacturing method of heat absorption protective material structural member 陕西千山航空电子有限责任公司 2022-12-16 CN claimed
US-20220279735-A1 ADDITIVE FOR MUSHROOM GROWTH MEDIUM KYOWA CHEMICAL INDUSTRY CO., LTD. (JP) 2022-09-08 US claimed
EP-4019623-A1 ADDITIVE FOR MUSHROOM GROWTH MEDIUM Kyowa Chemical Industry Co., Ltd (JP) 2022-06-29 EP claimed
WO-2021217171-A1 PARTICULATE LAUNDRY SCENT ADDITIVE THE PROCTER & GAMBLE COMPANY (US) 2021-10-28 WO claimed
EP-3901238-A1 PARTICULATE LAUNDRY SCENT ADDITIVE The Procter & Gamble Company (US) 2021-10-27 EP claimed
EP-3864106-A1 METAL NITRATE BASED COMPOSITIONS FOR USE AS PHASE CHANGE MATERIALS Sunamp Limited (GB) 2021-08-18 EP claimed
CN-112939046-A Comprehensive recycling method of coal-based solid waste 四川顺应动力电池材料有限公司 2021-06-11 CN claimed
CN-112888819-A Method for changing the color of textiles, fabrics and garments 尚科纺织企业工业及贸易公司 2021-06-01 CN claimed
CN-112888757-A Composition based on metal nitrates for use as phase change material 松耐普有限公司 2021-06-01 CN claimed
WO-2021033458-A1 ADDITIVE FOR MUSHROOM GROWTH MEDIUM 協和化学工業株式会社 2021-02-25 WO claimed
WO-2020225442-A1 METHOD FOR CHANGING THE COLOUR OF A TEXTILE, FABRIC AND GARMENT SANKO TEKSTIL ISLETMELERI SAN. VE TIC. A.S. (TR) 2020-11-12 WO claimed
EP-3736374-A1 METHOD FOR CHANGING THE COLOUR OF A TEXTILE, FABRIC AND GARMENT Sanko Tekstil Isletmeleri San. Ve Tic. A.S. (TR) 2020-11-11 EP claimed
US-4071605-A Process for the production of dibasic magnesium hypochlorite OLIN CORPORATION (US) 1978-01-31 US claimed