Water

Water

SCHEMBL80313

O.O.O.OOB(O)O.[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 SCHEMBL10896513 1.00
Water SCHEMBL8587972 1.00
Water SCHEMBL21333 1.00
Water SCHEMBL78471 1.00
Water SCHEMBL37908 1.00
Water SCHEMBL1946236 1.00
SCHEMBL1408311 0.95
Water SCHEMBL6226530 0.95 LMNA (0.30)
Water SCHEMBL3651763 0.95 LMNA (0.30)
Water SCHEMBL61018 0.95

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115232968-B Method for efficiently recycling tungsten and valuable metals from hard alloy waste 赣南师范大学 2024-01-16 CN claimed
CN-115232968-A Method for efficiently recovering tungsten and valuable metals from hard alloy waste 赣南师范大学 2022-10-25 CN claimed
US-20190187326-A1 TAGGED CHEMICAL DIVERTER CARBO CERAMICS INC (US) 2019-06-20 US claimed
US-20180180762-A1 TAGGED CHEMICAL DIVERTER CARBO CERAMICS INC (US) 2018-06-28 US claimed
US-9855589-B2 Support cleaning system STRATASYS, INC. (US) 2018-01-02 US claimed
US-9410075-B2 Far field diversion technique for treating subterranean formation HALLIBURTON ENERGY SERVICES, INC. (US) 2016-08-09 US claimed
US-20150209836-A1 SUPPORT CLEANING SYSTEM STRATASYS INC (US) 2015-07-30 US claimed
US-20140371114-A1 FAR FIELD DIVERSION TECHNIQUE FOR TREATING SUBTERRANEAN FORMATION HALLIBURTON ENERGY SERVICES, INC. (US) 2014-12-18 US claimed
US-8720568-B2 Swellable/degradable “sand” plug system for horizontal wells HALLIBURTON ENERGY SERVICES, INC. (US) 2014-05-13 US claimed
US-20080177109-A1 Novel Process for Preparation of Bicalutamide USV LIMITED (IN) 2008-07-24 US claimed
EP-1863759-A1 PROCESS FOR PREPARATION OF BICALUTAMIDE USV LIMITED (IN) 2007-12-12 EP claimed
US-20070276062-A1 Process For Producing An Epoxidized Elastomeric Polymer PIRELLI PNEUMATICI S.P.A. (IT) 2007-11-29 US claimed
WO-2006103689-A1 PROCESS FOR PREPARATION OF BICALUTAMIDE USV LIMITED (IN) 2006-10-05 WO claimed
EP-1697422-A1 PROCESS FOR PRODUCING AN EPOXIDIZED ELASTOMERIC POLYMER Pirelli Tyre S.p.A. (IT) 2006-09-06 EP claimed
WO-2005063821-A1 PROCESS FOR PRODUCING AN EPOXIDIZED ELASTOMERIC POLYMER PIRELLI PNEUMATICI S.P.A. (IT) 2005-07-14 WO claimed
US-5670473-A NONIONIC OR ANIONIC SURFACTANTS, SEQUESTERING AGENTS AND BUILDERS SUNBURST CHEMICALS, INC. (US) 1997-09-23 US claimed
US-5187332-A Coupling and recovering seismic detection sensors MOBIL OIL CORPORATION (US) 1993-02-16 US claimed
JP-8269494-A None JP disclosed
US-3832447-A METHOD FOR PRODUCING SODIUM PERBORATE TRIHYDRATE KALI CHEMIE AG 1974-08-27 US disclosed
US-3832447-A METHOD FOR PRODUCING SODIUM PERBORATE TRIHYDRATE KALI CHEMIE AG 1974-08-27 US disclosed