Water

Water

SCHEMBL226530

O.O[Si](O)(O)O.[AlH3].[KH].[NaH]

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 SCHEMBL130208 0.94
Water SCHEMBL664639 0.94
Water SCHEMBL27412506 0.94
SCHEMBL28638826 0.94
Water SCHEMBL665405 0.94
SCHEMBL41807 0.94
Water SCHEMBL28974157 0.94
Water SCHEMBL222696 0.89
Water SCHEMBL665702 0.89
Water SCHEMBL221949 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 69 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-11040307-B2 Method for removing contaminant from a fluid stream PURAFIL, INC. (US) 2021-06-22 US disclosed
US-20200246757-A1 NANOCOMPOSITE MEMBRANES AND METHODS OF MAKING AND USING SAME UNIV CALIFORNIA (US) 2020-08-06 US disclosed
US-20200188835-A1 Method For Removing Gaseous Contaminants From A Fluid Stream PURAFIL, INC. (US) 2020-06-18 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
WO-2018005459-A1 ADDITIVE MANUFACTURING SPOOL INCLUDING MOISTURE ABSORBING MATERIAL SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2018-01-04 WO disclosed
US-20170216769-A1 METHOD FOR REMOVING CONTAMINANT FROM A FLUID STREAM PURAFIL, INC. (US) 2017-08-03 US disclosed
US-9370763-B2 High capacity solid filtration media PURAFIL, INC. (US) 2016-06-21 US disclosed
US-20150314262-A1 High Capacity Solid Filtration Media PURAFIL, INC. (US) 2015-11-05 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
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
CN-1237982-C Cactus primary juice and its preparation method and application WANG ZHIZHONG (CN) 2006-01-25 CN disclosed
EP-1569734-A1 HIGH CAPACITY SOLID FILTRATION MEDIA PURAFIL, INC. (US) 2005-09-07 EP 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-2004047950-A1 HIGH CAPACITY SOLID FILTRATION MEDIA PURAFIL, INC. (US) 2004-06-10 WO disclosed
CN-1492803-A Composite proppant, filtration medium, gravel packing media, and sports field media, and methods for making and using same �޵��ǻ�ѧ��˾ 2004-04-28 CN disclosed
CN-1478510-A Cactus primary juice and its preparation method and application 王志忠 2004-03-03 CN disclosed
WO-2002099824-A2 NANOTUBE DEPOSITION ON ADSORBENTS IN WATER MAKER HEAT PUMP ZORNES DAVID A (US) 2002-12-12 WO disclosed