Water

Water

SCHEMBL20137416

B.O.O.[Zn]

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 SCHEMBL5076495 1.00
Water SCHEMBL28153057 0.87
Water SCHEMBL28126026 0.87
Water SCHEMBL28736633 0.87
Water SCHEMBL19510 0.82
Water SCHEMBL1316262 0.82 GSK3B (0.50)
Water SCHEMBL8061074 0.82 GSK3B (0.50)
Water SCHEMBL21048995 0.82
Water SCHEMBL22806512 0.82
Water SCHEMBL4951723 0.82 GSK3B (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024151513-A1 COMPOSITE STRUCTURE TICONA LLC (US) 2024-07-18 WO disclosed
US-20240242886-A1 Composite Structure TICONA LLC 2024-07-18 US disclosed
US-12002631-B2 Electrodeposited dielectric for a solid electrolytic capacitor KYOCERA AVX Components Corporation (US) 2024-06-04 US disclosed
CN-118098827-A Delamination-resistant solid electrolytic capacitor 京瓷AVX元器件公司 2024-05-28 CN disclosed
US-11837415-B2 Solid electrolytic capacitor KYOCERA AVX Components Corpration (US) 2023-12-05 US disclosed
CN-112272854-B solid electrolytic capacitor 京瓷AVX元器件公司 2023-09-26 CN disclosed
CN-113678217-B Delamination-resistant solid electrolytic capacitor 京瓷AVX元器件公司 2023-06-23 CN disclosed
US-20230118528-A1 Electrodeposited Dielectric for a Solid Electrolytic Capacitor KYOCERA AVX Components Corporation 2023-04-20 US disclosed
US-20220230815-A1 Solid Electrolytic Capacitor KYOCERA AVX Components Corporation 2022-07-21 US disclosed
WO-2022155165-A1 SOLID ELECTROLYTIC CAPACITOR KYOCERA AVX Components Corporation (US) 2022-07-21 WO disclosed
EP-3542381-A1 LEAD WIRE CONFIGURATION FOR A SOLID ELECTROLYTIC CAPACITOR AVX Corporation (US) 2019-09-25 EP disclosed
CN-110073454-A The lead-line configuration of solid electrolyte capacitators 阿维科斯公司 2019-07-30 CN disclosed
US-20190006117-A1 Solid Electrolytic Capacitor Assembly KYOCERA AVX Components Corporation 2019-01-03 US disclosed
US-20190006116-A1 Solid Electrolytic Capacitor Containing a Nanocoating KYOCERA AVX Components Corporation 2019-01-03 US disclosed
WO-2018208549-A1 LIFETIME DETERMINING TECHNIQUE FOR A SOLID ELECTROLYTIC CAPACITOR AND SYSTEM FOR THE SAME AVX CORPORATION (US) 2018-11-15 WO disclosed
US-20180321090-A1 Lifetime Determining Technique for a Solid Electrolytic Capacitor and System for the Same KYOCERA AVX Components Corporation 2018-11-08 US disclosed
WO-2018165065-A1 SOLID ELECTROLYTIC CAPACITOR ASSEMBLY AVX CORPORATION (US) 2018-09-13 WO disclosed
US-20180254151-A1 Solid Electrolytic Capacitor Assembly KYOCERA AVX Components Corporation 2018-09-06 US disclosed
US-20180137986-A1 Lead Wire Configuration for a Solid Electrolytic Capacitor KYOCERA AVX Components Corporation 2018-05-17 US disclosed
US-20180137987-A1 Casing Material for a Solid Electrolytic Capacitor KYOCERA AVX Components Corporation 2018-05-17 US disclosed