Water

Water

SCHEMBL1760853

CN1CCOCC1.O

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 SCHEMBL3979759 1.00 CA12 (0.43)
Ammonia Solution, Strong SCHEMBL28389103 0.97 CA12 (0.41)
Hydrochloric Acid SCHEMBL6025830 0.97
SCHEMBL20614479 0.96 CA12 (0.45)
SCHEMBL8136165 0.96
SCHEMBL10001930 0.96 CA12 (0.45)
SCHEMBL2123718 0.96 CA12 (0.45)
SCHEMBL1221354 0.96
SCHEMBL4622 0.96
Fluoride SCHEMBL28310400 0.96

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118497918-B Preparation method and application of lyocell fiber containing chlorella component 华东理工大学 2024-11-15 CN claimed
CN-118497918-A Preparation method and application of lyocell fiber containing chlorella component 华东理工大学 2024-08-16 CN claimed
CN-114835312-B Resourceful treatment method of liquid dye wastewater 杭州珩钧环境工程有限公司 2023-04-18 CN claimed
CN-112362773-B Detection method and application of N-methylmorpholine oxide and decomposition products for Lyocell fibers 山东英利实业有限公司 2022-11-08 CN claimed
CN-110699861-A Production method of high-strength regenerated nano-cellulose mixed membrane 王博楼 2020-01-17 CN claimed
CN-106283276-A The recovery method of N methylmorpholineoxide during solvent method production cellulose 中国纺织科学研究院 2017-01-04 CN claimed
JP-4696123-B2 2011-06-08 JP claimed
US-20090142596-A1 METHOD FOR PRODUCING MULTI-LAYERED SURFACE STRUCTURES, PARTICLES OR FIBRES BASF AKTIENGESELLSCHAFT (DE) 2009-06-04 US claimed
EP-1814919-B1 METHOD FOR PRODUCING MULTI-LAYERED SURFACE STRUCTURES, PARTICLES OR FIBRES BASF SE (DE) 2008-09-24 EP claimed
EP-1814919-A2 METHOD FOR PRODUCING MULTI-LAYERED SURFACE STRUCTURES, PARTICLES OR FIBRES BASF AKTIENGESELLSCHAFT (DE) 2007-08-08 EP claimed
WO-2006045534-A2 METHOD FOR PRODUCING MULTI-LAYERED SURFACE STRUCTURES, PARTICLES OR FIBRES BASF AKTIENGESELLSCHAFT (DE) 2006-05-04 WO claimed
CN-117924214-B Method for recycling N-methylmorpholine from N-methylmorpholine-containing wastewater 永农生物科学有限公司 2025-12-19 CN disclosed
CN-120003117-A Hot-press forming non-woven heat-insulating fabric and preparation method thereof 上海铭茜实业有限公司 2025-05-16 CN disclosed
CN-119371375-A Preparation method of N-methylmorpholine 石家庄合佳制药有限公司 2025-01-28 CN disclosed
CN-119162680-A Skin-moistening antioxidant lyocell fiber and preparation method thereof 江苏金太阳纺织科技股份有限公司 2024-12-20 CN disclosed
WO-1998038859-A1 SULFONYL DIVALENT ARYL OR HETEROARYL HYDROXAMIC ACID COMPOUNDS MONSANTO COMPANY (US) 1998-09-11 WO disclosed
WO-1998003164-A1 THIOL SULFONE METALLOPROTEASE INHIBITORS MONSANTO COMPANY (US) 1998-01-29 WO disclosed
CN-1151701-A Concatemer-polymer complexes, process for their preparation and pharmaceutical agents containing them SCHERING AG (DE) 1997-06-11 CN disclosed
CN-1016868-B Process for preparing 5-aralkyl-4-alkoxy-2 (5H) -furanone SCHWABE WILLMAR GMBH & CO (DE) 1992-06-03 CN disclosed
US-4808607-A ATHEROSCLEROSIS, HYPERLIPOPROTEINEMIA SANDOZ PHARM. CORP. (US) 1989-02-28 US disclosed