Water

Water

SCHEMBL3790318

O.[Fe].[Mn]

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 SCHEMBL1719999 1.00
Water SCHEMBL28285982 1.00
Water SCHEMBL28544021 0.87
Water SCHEMBL338988 0.87
Water SCHEMBL29248748 0.87
Water SCHEMBL23234063 0.87
Water SCHEMBL28986662 0.87
Water SCHEMBL20769871 0.87
Water SCHEMBL11587171 0.87
Water SCHEMBL22829845 0.87

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120039853-A Ferromanganese phosphate precursor, lithium ferromanganese phosphate and preparation method thereof, battery monomer, battery device and electricity utilization device 江苏时代新能源科技有限公司 2025-05-27 CN claimed
CN-119841297-A Preparation method of lithium iron manganese phosphate anode material 锂源(深圳)科学研究有限公司 2025-04-18 CN claimed
CN-119774664-A Ferromanganese precursor, lithium ferromanganese phosphate positive electrode material, preparation method of lithium ferromanganese phosphate positive electrode material and lithium ion battery 益阳高发桑瑞新材料有限公司 2025-04-08 CN claimed
CN-119774665-A Method for synchronously generating potassium ferrate, potassium permanganate and ferro-manganese oxide 上海理工大学 2025-04-08 CN claimed
CN-117996046-B Lithium iron manganese borate composite material and preparation method and application thereof 湖北万润新能源科技股份有限公司 2024-10-11 CN claimed
CN-118723960-A Ferromanganese atomic-level mixed lithium ferromanganese phosphate positive electrode material, and preparation method and application thereof 格林美股份有限公司 2024-10-01 CN claimed
CN-118103323-A Lithium iron manganese phosphate positive electrode material and preparation method and application thereof 广东邦普循环科技有限公司 2024-05-28 CN claimed
CN-117996046-A Lithium iron manganese borate composite material and preparation method and application thereof 湖北万润新能源科技股份有限公司 2024-05-07 CN claimed
CN-117855432-A Lithium iron manganese phosphate composite material and preparation method and application thereof 天津容百斯科兰德科技有限公司 2024-04-09 CN claimed
CN-117845241-A Method for preparing propargylamine compounds by electrocatalytic reaction 中国石油化工股份有限公司 2024-04-09 CN claimed
CN-110354079-A A kind of lipid peroxide generator and its preparation method and application 中国药科大学 2019-10-22 CN claimed
CN-110252399-A Polymer support loaded catalyst composite material, its application and preparation method 上海大学 2019-09-20 CN claimed
EP-3500362-A1 METAL ION EXTRACTION FROM BRINES SRI International (US) 2019-06-26 EP claimed
US-20190176142-A1 METAL ION EXTRACTION FROM BRINES EXSORBTION INC. 2019-06-13 US claimed
CN-106298256-B A kind of nanostructured manganese iron oxidation combination electrode material and preparation method thereof for supercapacitor 宁波中车新能源科技有限公司 2019-03-08 CN claimed
CN-108947515-A A kind of texturing Mn ferrite ceramics and preparation method 江苏科技大学 2018-12-07 CN claimed
US-9555134-B2 Manganese-oxo clusters as contrast agents for magnetic resonance imaging GEORGETOWN UNIVERSITY (US) 2017-01-31 US claimed
CN-105253986-A Denitrogenation agent POWERCHINA ZHONGNAN ENGINEERING CORP LTD 2016-01-20 CN claimed
US-20120134932-A1 Manganese-Oxo Clusters as Contrast Agents for Magnetic Resonance Imaging GEORGETOWN UNIVERSITY (US) 2012-05-31 US claimed
WO-2010048268-A2 MANGANESE-OXO CLUSTERS AS CONTRAST AGENTS FOR MAGNETIC RESONANCE IMAGING GEORGETOWN UNIVERSITY (US) 2010-04-29 WO claimed