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 SCHEMBL27681516 | 1.00 | — | — | |
| SCHEMBL11671915 | 0.93 | — | — | |
| SCHEMBL19651 | 0.93 | — | — | |
| SCHEMBL13481775 | 0.93 | — | — | |
| Hydrogen Sulfide SCHEMBL11457976 | 0.86 | — | — | |
| Charcoal, Activated SCHEMBL9473714 | 0.86 | — | — | |
| SCHEMBL8462651 | 0.86 | — | — | |
| SCHEMBL9192536 | 0.86 | — | — | |
| Ammonia Solution, Strong SCHEMBL822278 | 0.86 | — | — | |
| Ethylene SCHEMBL5747488 | 0.86 | — | — |
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 71 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10449242-B2 | Compositions and methods for the treatment and prevention of Ebp pilus-related diseases | WASHINGTON UNIVERSITY (US) | 2019-10-22 | — | — | US | claimed |
| US-20180055923-A1 | COMPOSITIONS AND METHODS FOR THE TREATMENT AND PREVENTION OF Ebp PILUS-RELATED DISEASES | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2018-03-01 | — | — | US | claimed |
| WO-2015186108-A1 | 2 LAYERS TABLET ORAL DOSAGE FORM FOR VARIOUS DRUG RELEASE | UNIVERSITY OF THE WITWATERSRAND, JOHANNESBURG (ZA) | 2015-12-10 | — | — | WO | claimed |
| EP-1144310-B1 | MESOPOROUS SILICA FILM FROM A SOLUTION CONTAINING A SURFACTANT AND METHODS OF MAKING SAME | BATTELLE MEMORIAL INSTITUTE (US) | 2007-05-30 | — | — | EP | claimed |
| EP-1476600-A4 | CHEMICAL COMPOUNDS AND METHODS FOR REMOVING DYE | INTERFACE INC (US) | 2007-03-28 | — | — | EP | claimed |
| US-20050198742-A1 | Chemical compounds and methods for removing dye | INTERFACE, INC. | 2005-09-15 | — | — | US | claimed |
| EP-1476600-A1 | CHEMICAL COMPOUNDS AND METHODS FOR REMOVING DYE | INTERFACE, INC. (US) | 2004-11-17 | — | — | EP | claimed |
| WO-2003064752-A1 | CHEMICAL COMPOUNDS AND METHODS FOR REMOVING DYE | INTERFACE, INC. (US) | 2003-08-07 | — | — | WO | claimed |
| EP-0450597-A2 | Cosmetic gel stick compositions | Bristol-Myers Squibb Company (US) | 1991-10-09 | — | — | EP | claimed |
| US-20240041037-A1 | DISINFECTANT AND USE THEREOF | Meneghini, Thomas (DE) | 2024-02-08 | — | — | US | disclosed |
| US-20240043941-A1 | SYSTEMS, METHODS, AND APPARATUSES FOR CONCENTRATION AND IDENTIFICATION OF A MICROORGANISM FROM BLOOD | BIOFIRE DIAGNOSTICS LLC (US) | 2024-02-08 | — | — | US | disclosed |
| CN-106799168-A | A kind of cleaning agent for reverse osmosis membrane | 新疆德蓝股份有限公司 | 2017-06-06 | — | — | CN | disclosed |
| WO-2015186108-A1 | 2 LAYERS TABLET ORAL DOSAGE FORM FOR VARIOUS DRUG RELEASE | UNIVERSITY OF THE WITWATERSRAND, JOHANNESBURG (ZA) | 2015-12-10 | — | — | WO | disclosed |
| EP-1845086-B1 | N-(2-substituted phenyl)-N-methoxycarbamates and their preparation and use thereof | SHENYANG RES INST CHEMICAL IND (CN) | 2013-04-24 | — | — | EP | disclosed |
| WO-1993010677-A1 | SPECIFIC EATABLE TASTE MODIFIERS | BIORESEARCH, INC. (US) | 1993-06-10 | — | — | WO | disclosed |
| EP-0433285-A4 | ASBESTOS REMOVAL METHOD AND SYSTEM | — | 1992-05-20 | — | — | EP | disclosed |
| EP-0433285-A1 | ASBESTOS REMOVAL METHOD AND SYSTEM | FLYNN, Thomas S. (US) | 1991-06-26 | — | — | EP | disclosed |
| US-4854966-A | HERBICIDES | STAUFFER CHEMICAL COMPANY (US) | 1989-08-08 | — | — | US | disclosed |
| WO-1989004729-A1 | ASBESTOS REMOVAL METHOD AND SYSTEM | FLYNN THOMAS S (US) | 1989-06-01 | — | — | WO | disclosed |
| EP-0143099-B1 | STORAGE STABLE EMULSION FLOWABLE FORMULATION CONTAINING A MIXTURE OF ALACHLOR/ATRAZINE AS THE ACTIVE AGENT | MONSANTO COMPANY (US) | 1989-02-01 | — | — | EP | disclosed |