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 SCHEMBL6226530 | 1.00 | LMNA (0.30) | — | |
| Water SCHEMBL3651763 | 1.00 | LMNA (0.30) | — | |
| Water SCHEMBL6740576 | 1.00 | LMNA (0.30) | — | |
| Water SCHEMBL179851 | 1.00 | — | — | |
| Water SCHEMBL10439033 | 1.00 | — | — | |
| Water SCHEMBL7159956 | 0.95 | — | — | |
| Water SCHEMBL10896513 | 0.95 | — | — | |
| Water SCHEMBL1946236 | 0.95 | — | — | |
| Water SCHEMBL37908 | 0.95 | — | — | |
| Water SCHEMBL21333 | 0.95 | — | — |
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
Appears in 2259 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1969112-B1 | CLEANING AGENT COMPRISING COMPLEXES WITH BLEACH CATALYTIC ACTIVITY | HENKEL AG & CO KGAA (DE) | 2011-06-29 | — | — | EP | claimed |
| EP-0850292-B2 | COLOUR TRANSFER-INHIBITING WASHING AGENT | HENKEL AG & CO KGAA (DE) | 2010-12-29 | — | — | EP | claimed |
| EP-0639639-B2 | Detergent compositions comprising percarbonate bleaching agents | PROCTER & GAMBLE (US) | 2010-07-28 | — | — | EP | claimed |
| US-20090258811-A1 | Automatic Dosing System | MIFA AG FRENKEDORF (CH) | 2009-10-15 | — | — | US | claimed |
| CN-100390259-C | Metal ligand containing bleaching compositions | UNIV CARNEGIE MELLON (US) | 2008-05-28 | — | — | CN | claimed |
| US-7371714-B2 | Chemical agent decontamination composition comprising a perfluorinated alkyl bromide | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) | 2008-05-13 | — | — | US | claimed |
| EP-1918360-A1 | Dosed or dosable washing agent | MIFA AG FRENKENDORF (CH) | 2008-05-07 | — | — | EP | claimed |
| EP-1911833-A1 | Dosed or dosable washing agent | MIFA AG FRENKENDORF (CH) | 2008-04-16 | — | — | EP | claimed |
| US-20080085848-A1 | CHEMICAL AGENT DECONTAMINATION COMPOSITION COMPRISING A PERFLUORINATED ALKYL BROMIDE | ARMY, UNITED STATES | 2008-04-10 | — | — | US | claimed |
| EP-1890734-A2 | PRODUCTS FOR TONGUE CLEANING AND FOR PREVENTING AND TREATING HALITOSIS AND EQUIPMENT FOR TONGUE CLEANING | Conçeicão, Maurício Duarte da (BR) | 2008-02-27 | — | — | EP | claimed |
| US-4490269-A | PERBORATES AND PERSULFATES; STABILITY | WARNER-LAMBERT COMPANY (US) | 1984-12-25 | — | — | US | claimed |
| EP-0123525-A2 | A cleansing composition and method of preparation thereof | WARNER-LAMBERT COMPANY (US) | 1984-10-31 | — | — | EP | claimed |
| EP-0042187-B1 | DETERGENT COMPOSITION CONTAINING LOW LEVEL OF SUBSTITUTED POLYAMINES | THE PROCTER & GAMBLE COMPANY (US) | 1984-07-25 | — | — | EP | claimed |
| EP-0105690-A1 | Bleaching compositions | THE PROCTER & GAMBLE COMPANY (US) | 1984-04-18 | — | — | EP | claimed |
| EP-0098108-A1 | Detergent composition | UNILEVER PLC (GB) | 1984-01-11 | — | — | EP | claimed |
| US-4422950-A | EFFERVESCENT MIXTURE INCLUDING ACTIVATOR, PEROXDBORATE AND CARRIER | LEVER BROTHERS COMPANY (US) | 1983-12-27 | — | — | US | claimed |
| EP-0053859-A1 | Bleach activator granules | UNILEVER N.V. (NL) | 1982-06-16 | — | — | EP | claimed |
| EP-0042187-A1 | Detergent composition containing low level of substituted polyamines | THE PROCTER & GAMBLE COMPANY (US) | 1981-12-23 | — | — | EP | claimed |
| US-4174418-A | Antibacterial textile finishes utilizing zironyl acetate complexes of inorganic peroxides | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) | 1979-11-13 | — | — | US | claimed |
| US-4115422-A | ANTIBACTERIAL TEXTILE FINISHES UTILIZING ZIRCONYL ACETATE COMPLEXES OF INORGANIC PEROXIDES | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) | 1978-09-19 | — | — | US | claimed |