Water

Water

SCHEMBL11706166

O.O.O.O.O.[Cr]

nearest known ligand 0.00

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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 SCHEMBL1134216 1.00
Water SCHEMBL1773234 1.00
Water SCHEMBL11517476 1.00
Water SCHEMBL3924078 1.00
Water SCHEMBL8960314 1.00
Water SCHEMBL9011506 1.00
Water SCHEMBL10610102 1.00
Water SCHEMBL597252 1.00
Water SCHEMBL15803 1.00
Water SCHEMBL4426501 1.00

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116179917-B Aluminum-chromium intermediate alloy powder for 3D printing and preparation method thereof 承德天大钒业有限责任公司 2024-09-17 CN claimed
CN-117214213-A Fuse sample preparation method for measuring element content in silicon oxide by X-ray fluorescence spectrum 厦门厦钨新能源材料股份有限公司 2023-12-12 CN claimed
CN-116179917-A Aluminum-chromium intermediate alloy powder for 3D printing and preparation method thereof 承德天大钒业有限责任公司 2023-05-30 CN claimed
CN-119241280-A Full-polished glazed tile with deep continuous concave textures and preparation method thereof 丰城市东鹏陶瓷有限公司 2025-01-03 CN disclosed
CN-119050300-A Positive electrode material, preparation method and lithium ion battery 合肥国轩高科动力能源有限公司 2024-11-29 CN disclosed
CN-116179917-B Aluminum-chromium intermediate alloy powder for 3D printing and preparation method thereof 承德天大钒业有限责任公司 2024-09-17 CN disclosed
CN-118086627-A Method for reducing temperature drop of LF (ladle furnace) reinforced bar head 广东中南钢铁股份有限公司 2024-05-28 CN disclosed
CN-117214213-A Fuse sample preparation method for measuring element content in silicon oxide by X-ray fluorescence spectrum 厦门厦钨新能源材料股份有限公司 2023-12-12 CN disclosed
CN-116759569-A Multi-element composite chromium oxide positive electrode material and application thereof in battery 武汉中原长江科技发展有限公司 2023-09-15 CN disclosed
CN-116179917-A Aluminum-chromium intermediate alloy powder for 3D printing and preparation method thereof 承德天大钒业有限责任公司 2023-05-30 CN disclosed
CN-112201773-B Preparation method and application of copper-coated chromium oxide positive electrode 哈尔滨工业大学 2021-12-24 CN disclosed
EP-2744024-B1 METHOD FOR PRODUCING ELECTRODE CATALYST FOR FUEL CELLS SHOWA DENKO KK (JP) 2020-05-06 EP disclosed
EP-2665119-B1 METHOD FOR PRODUCING FUEL CELL ELECTRODE CATALYST, FUEL CELL ELECTRODE CATALYST, AND USES THEREOF SHOWA DENKO KK (JP) 2018-10-24 EP disclosed
US-10044045-B2 Process for producing a fuel cell electrode catalyst, fuel cell electrode catalyst and use thereof SHOWA DENKO K.K. (JP) 2018-08-07 US disclosed
US-9350025-B2 Method for producing fuel cell electrode catalyst, fuel cell electrode catalyst, and uses thereof SHOWA DENKO K.K. (JP) 2016-05-24 US disclosed
US-20140170528-A1 PROCESS FOR PRODUCING A FUEL CELL ELECTRODE CATALYST, FUEL CELL ELECTRODE CATALYST AND USE THEREOF SHOWA DENKO K.K. (JP) 2014-06-19 US disclosed
EP-2744024-A1 METHOD FOR PRODUCING ELECTRODE CATALYST FOR FUEL CELLS, ELECTRODE CATALYST FOR FUEL CELLS, AND USE OF SAME Showa Denko K.K. (JP) 2014-06-18 EP disclosed
EP-2665119-A1 METHOD FOR PRODUCING FUEL CELL ELECTRODE CATALYST, FUEL CELL ELECTRODE CATALYST, AND APPLICATION THEREOF Showa Denko K.K. (JP) 2013-11-20 EP disclosed
US-20130295483-A1 METHOD FOR PRODUCING FUEL CELL ELECTRODE CATALYST, FUEL CELL ELECTRODE CATALYST, AND USES THEREOF SHOWA DENKO K.K. (JP) 2013-11-07 US disclosed
US-4031299-A Process for forming a polyvinyl chloride extender resin by incorporating in the suspension polymerization medium a prehomogenized solution of a polyallyl compound and a low molecular polymer of propylene STAUFFER CHEMICAL COMPANY (US) 1977-06-21 US disclosed