Water

Water

SCHEMBL223307

O.O[Si](O)(O)O.[AlH3].[BaH2].[CaH2].[NaH].[SrH2]

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
SCHEMBL27923105 0.95
Water SCHEMBL1744434 0.95
Water SCHEMBL221949 0.90
Fluoride SCHEMBL5426930 0.90
Water SCHEMBL222710 0.90
Water SCHEMBL222696 0.90
Water SCHEMBL220756 0.89
SCHEMBL28806006 0.89
SCHEMBL27768451 0.89
Water SCHEMBL223199 0.89

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006047812-A1 WATER TREATMENT HURSTWELL PTY LIMITED (AU) 2006-05-11 WO claimed
US-20200246757-A1 NANOCOMPOSITE MEMBRANES AND METHODS OF MAKING AND USING SAME UNIV CALIFORNIA (US) 2020-08-06 US disclosed
US-10618013-B2 Nanocomposite membranes and methods of making and using same THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2020-04-14 US disclosed
CN-103917282-B Multiple separation filter and antioxidant water produced by using the same LS NOVA Co.,Ltd. (JP) 2015-08-26 CN disclosed
CN-103917282-A Multiple separation filter and antioxidant water produced by using the same LS NOVA CO LTD 2014-07-09 CN disclosed
CN-101299926-B Methods and compositions for improving stool quality HILLS PET NUTRITION INC 2014-03-05 CN disclosed
EP-2401924-A1 Methods for enhancing palatability of compositions for animal consumption Hill's Pet Nutrition, Inc. (US) 2012-01-04 EP disclosed
EP-1879469-B1 METHODS FOR ENHANCING PALATABILITY OF COMPOSITIONS FOR ANIMAL CONSUMPTION HILLS PET NUTRITION INC (US) 2011-11-09 EP disclosed
US-8029857-B2 Compaction resistance, flux flow characteristics; water purification; interfacial polymerization production of semipermeable polyamide matrices THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-10-04 US disclosed
CN-101217882-B Method for enhancing palatability of compositions for animal consumption HILLS PET NUTRITION INC 2011-07-13 CN disclosed
WO-2007056686-A1 METHODS AND COMPOSITIONS FOR IMPROVING STOOL QUALITY HILL'S PET NUTRITION, INC. (US) 2007-05-18 WO disclosed
US-7208610-B2 Process for isomerization of 2-halothiophene to 3-halothiophene HONEYWELL INTERNATIONAL INC. (US) 2007-04-24 US disclosed
WO-2006122196-A2 METHODS FOR ENHANCING PALATABILITY OF COMPOSITIONS FOR ANIMAL CONSUMPTION HILL'S PET NUTRITION, INC. (US) 2006-11-16 WO disclosed
WO-2006098872-A2 NANOCOMPOSITE MEMBRANES AND METHODS OF MAKING AND USING SAME THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2006-09-21 WO disclosed
WO-2006076139-A1 PROCESS FOR ISOMERIZATION OF 2-HALOTHIOPHENE TO-3-HALOTHIOPHENE HONEYWELL INTERNATIONAL INC. (US) 2006-07-20 WO disclosed
US-20060155133-A1 Process for isomerization of 2-halothiophene to 3-halothiophene HONEYWELL INTERNATIONAL INC. 2006-07-13 US disclosed
WO-2006047812-A1 WATER TREATMENT HURSTWELL PTY LIMITED (AU) 2006-05-11 WO disclosed
WO-2005063660-A2 METHOD FOR THE PURIFICATION OF PHARMACEUTICAL GRADE HFC-134A AND POLYMER GRADE HCFC-22 HONEYWELL INTERNATIONAL INC. (US) 2005-07-14 WO disclosed
US-20050133360-A1 Process for the purification of pharmaceutical grade HFC-134a and polymer grade HCFC-22 HONEYWELL INTERNATIONAL INC. 2005-06-23 US disclosed
WO-2002099824-A2 NANOTUBE DEPOSITION ON ADSORBENTS IN WATER MAKER HEAT PUMP ZORNES DAVID A (US) 2002-12-12 WO disclosed