Water

Water

SCHEMBL222413

O.O.O=[Si]([O-])[O-].O=[Si]([O-])[O-].O=[Si]([O-])[O-].O=[Si]([O-])[O-].O=[Si]([O-])[O-].[Al+3].[Al+3].[Ca+2].[Ca+2]

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 SCHEMBL14150848 1.00
Water SCHEMBL11151253 0.95
Water SCHEMBL223198 0.95
Water SCHEMBL5119443 0.95
Water SCHEMBL226049 0.95
Water SCHEMBL220755 0.95
Water SCHEMBL29688 0.94
Water SCHEMBL10587237 0.94
Water SCHEMBL1879987 0.94
SCHEMBL97357 0.94

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118164728-A Composite impermeable material and preparation method and application thereof 国能神东煤炭集团有限责任公司 2024-06-11 CN claimed
CN-115558373-A Water-based epoxy primer for rail transit and preparation method thereof 广州集泰化工股份有限公司 2023-01-03 CN claimed
EP-3323486-B1 MOISTURE ABSORBING FILTER ASSEMBLY PURADYN FILTER TECH INC (US) 2020-05-27 EP claimed
EP-3323486-A1 AIR AND CONTAMINANT ISOLATION AND REMOVAL APPARATUS Puradyn Filter Technologies Inc. (US) 2018-05-23 EP claimed
EP-3248953-A1 CEMENT COMPOSITION Halliburton Energy Services, Inc. (US) 2017-11-29 EP claimed
US-8573407-B2 Air and contaminant isolation and removal apparatus and method Puradyn Filter Technologies, Inc. (US) 2013-11-05 US claimed
EP-2495022-A1 Air and contaminant isolation and removal apparatus and method Puradyn Filter Technologies Inc. (US) 2012-09-05 EP claimed
US-7939633-B2 Using zeolite adsorbents to preferentially bind color and odor components associated with yellow corn zein; improving paints, inks, coatings for food products, tableted medicaments, paper products, microencapsulating agents, adhesives in laminated wood products and bases for chewing gums THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2011-05-10 US claimed
EP-2314555-A1 Zeolite-containing cement compostion Halliburton Energy Services, Inc. (US) 2011-04-27 EP claimed
US-20110056879-A1 AIR AND CONTAMINANT ISOLATION AND REMOVAL APPARATUS AND METHOD Puradyn Filter Technologies, Inc. (US) 2011-03-10 US claimed
US-20080242842-A1 Decolorization/deodorization of corn zein products THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2008-10-02 US claimed
WO-2008118772-A1 DECOLORAZATION/DEODORIZATION OF CORN ZEIN PRODUCT THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2008-10-02 WO claimed
WO-2006047812-A1 WATER TREATMENT HURSTWELL PTY LIMITED (AU) 2006-05-11 WO claimed
US-6989057-B2 Zeolite-containing cement composition HALLIBURTON ENERGY SERVICES, INC. (US) 2006-01-24 US claimed
WO-2005095534-A2 FLUID LOSS ADDITIVES FOR CEMENT SLURRIES HALLIBURTON ENERGY SERVICES, INC. (US) 2005-10-13 WO claimed
US-20040244977-A1 Fluid loss additives for cement slurries HALLIBURTON ENERGY SERVICES, INC. 2004-12-09 US claimed
EP-1428805-A1 Cement composition Halliburton Energy Services, Inc. (US) 2004-06-16 EP claimed
US-20040107877-A1 Zeolite-containing cement composition HALLIBURTON ENERGY SERVICES, INC. (US) 2004-06-10 US claimed
JP-52084199-A None JP disclosed
JP-S5284199-A PRODUCTION OF CALCIUM SILICATE MATSUSHITA ELECTRIC WORKS LTD 1977-07-13 JP disclosed