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.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Water SCHEMBL1305747 | 1.00 | — | — | |
| Water SCHEMBL2775514 | 1.00 | — | — | |
| Water SCHEMBL28190481 | 1.00 | — | — | |
| Water SCHEMBL28294686 | 0.87 | — | — | |
| Water SCHEMBL974883 | 0.87 | — | — | |
| Water SCHEMBL20163220 | 0.87 | — | — | |
| Water SCHEMBL7261161 | 0.87 | — | — | |
| Water SCHEMBL7724625 | 0.87 | — | — | |
| Water SCHEMBL23298299 | 0.82 | — | — | |
| Water SCHEMBL15656964 | 0.82 | — | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1209482-C | Active raw material for thermal sprayed system, thermal sprayed electrodes of energy storage and conversion device made of it and manufacture method thereof | US NANOCORP INC (US) | 2005-07-06 | — | — | CN | claimed |
| CN-1273615-A | Active material feedstock for thermal spray systems, thermal spray electrode for energy storage and energy conversion devices made therefrom, and method of making same | US NANOCORP INC (US) | 2000-11-15 | — | — | CN | claimed |
| JP-7122275-A | — | — | None | — | — | JP | disclosed |
| US-20230180748-A1 | BIOACTIVE COMPOSITION FOR KILLING CELLS | AGXX INTELLECTUAL PROPERTY HOLDING GMBH (DE) | 2023-06-15 | — | — | US | disclosed |
| CN-115666248-A | Bioactive compositions for cell killing | AGXX知识产权控股有限公司 | 2023-01-31 | — | — | CN | disclosed |
| CN-1330480-C | Structures incorporating polymer-inorganic particle blends | NEOPHOTONICS CORP (US) | 2007-08-08 | — | — | CN | disclosed |
| JP-2004288641-A | ELECTROCHEMICAL BATTERY, CATHODE MATERIAL AND MANUFACTURING METHOD | WILSON GREATBATCH TECHNOLOGIES INC | 2004-10-14 | — | — | JP | disclosed |
| JP-2003242965-A | TWO SHEETS OF POSITIVE ELECTRODE COLLECTORS FOR ALKALINE METAL ION ELECTROCHEMICAL BATTERY | WILSON GREATBATCH TECHNOLOGIES INC | 2003-08-29 | — | — | JP | disclosed |
| JP-2002270162-A | ELECTROCHEMICAL CELL CONSTITUTED BY ALKALINE METAL BATTERY OR ION ELECTROCHEMICAL BATTERY CONTAINING DOUBLE CURRENT COLLECTING BODY CATHODE STRUCTURE WITH USAGE OF TWO KINDS OF ACTIVE MATERIAL MIXTURES | WILSON GREATBATCH LTD | 2002-09-20 | — | — | JP | disclosed |
| JP-2002270185-A | ELECTROCHEMICAL BATTERY HAVING ELECTRODE MADE OF VANADIUM OXIDE SILVER COATED ON CURRENT COLLECTOR | WILSON GREATBATCH LTD | 2002-09-20 | — | — | JP | disclosed |
| JP-H07122275-A | CATHODE FOR ELECTROCHEMICAL CELL, PREPARING METHOD THEREFOR AND ELECTROCHEMICAL CELL | WILSON GREATBATCH LTD | 1995-05-12 | — | — | JP | disclosed |