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 SCHEMBL2012731 | 1.00 | — | — | |
| Water SCHEMBL31656559 | 0.82 | — | — | |
| Iodide SCHEMBL320751 | 0.82 | — | — | |
| Water SCHEMBL3172530 | 0.67 | — | — | |
| Water SCHEMBL25293610 | 0.67 | — | — | |
| Water SCHEMBL25293755 | 0.67 | — | — | |
| Water SCHEMBL896220 | 0.67 | — | — | |
| Water SCHEMBL11605205 | 0.67 | — | — | |
| Water SCHEMBL2028125 | 0.67 | — | — | |
| Water SCHEMBL96825 | 0.67 | — | — |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116574270-A | Cobalt-based metal organic framework material and preparation method and application thereof | 吉林大学 | 2023-08-11 | — | — | CN | disclosed |
| EP-3132845-B1 | NITROGEN-CONTAINING CARBON MATERIAL AND METHOD FOR MANUFACTURING SAME, AND SLURRY, INK, AND ELECTRODE FOR FUEL CELL | ASAHI CHEMICAL IND (JP) | 2018-11-21 | — | — | EP | disclosed |
| US-9704612-B2 | Composition of silver-conjugated compound composite | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2017-07-11 | — | — | US | disclosed |
| US-8866134-B2 | Light-emitting device and photovoltaic cell, and method for manufacturing the same | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2014-10-21 | — | — | US | disclosed |
| EP-2687304-A1 | METAL COMPLEX COMPOSITIONS AND MIXTURE THEREOF | Sumitomo Chemical Company Limited (JP) | 2014-01-22 | — | — | EP | disclosed |
| US-20140001422-A1 | COMPOSITION OF SILVER-CONJUGATED COMPOUND COMPOSITE | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2014-01-02 | — | — | US | disclosed |
| US-20130341571-A1 | METALLIC COMPOSITE COMPOSITION AND MIXTURE THEREOF | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2013-12-26 | — | — | US | disclosed |
| US-20130099224-A1 | LIGHT-EMITTING DEVICE AND PHOTOVOLTAIC CELL, AND METHOD FOR MANUFACTURING THE SAME | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2013-04-25 | — | — | US | disclosed |
| EP-1589042-B1 | SOLID PHASE POLYMERISATION | TEIJIN LTD (JP) | 2009-03-04 | — | — | EP | disclosed |
| US-7338997-B2 | Solid-phase polymerization of a mixture of acrylonitrile and comonomer(s) that is absorbed into a template of layered, crystalline, hexagonal and/or trigonal cadmium iodide, cadmium chloride or cadmium sulfide; isotactic triad proportion of the acrylonitrile structural chain is at least 35% | TEIJIN LIMITED (JP) | 2008-03-04 | — | — | US | disclosed |
| US-20060183834-A1 | Polymer for carbon fiber precursor | TEIJIN LIMITED | 2006-08-17 | — | — | US | disclosed |
| EP-1589042-A1 | POLYMER FOR CARBON FIBER PRECURSOR | TEIJIN LIMITED (JP) | 2005-10-26 | — | — | EP | disclosed |
| US-4891069-A | CATALYST FOR REDUCTION OF METAL COMPOUND BY GENERATED HYDROGEN | TECHNO INSTRUMENTS INVESTMENTS 1983 LTD. (IL) | 1990-01-02 | — | — | US | disclosed |
| US-4790912-A | ELECTROLYTICALLY-GENERATED HYDROGEN AND CATALYST CONVERT METAL SALT IN BATH TO METAL | TECHNO-INSTRUMENTS INVESTMENTS LTD. (IL) | 1988-12-13 | — | — | US | disclosed |
| US-4749449-A | PLATING ON CATALYZED THROUGH HOLE WALL IN PATTERENED CONDUCTIVE AND INSULATING LAYERS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1988-06-07 | — | — | US | disclosed |
| EP-0248683-A2 | Composition and process for the electrolytic coating of circuit boards without an electroless metal coating | A.P.T. Advanced Plating Technologies (IL) | 1987-12-09 | — | — | EP | disclosed |