Known targets — ChEMBL curated mechanism
ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 known ✓ | P00915 | 3/20 | 0.40 |
| ▸ | CA4 known ✓ | P22748 | 1/20 | 0.38 |
| ▸ | CA2 known ✓ | P00918 | 1/20 | 0.36 |
| ▸ | SCN4A known ✓ | P35499 | 1/20 | 0.34 |
| ▸ | SCN5A known ✓ | Q14524 | 1/20 | 0.34 |
| ▸ | SCN9A known ✓ | Q15858 | 1/20 | 0.34 |
| ▸ | SCN3A known ✓ | Q9NY46 | 1/20 | 0.34 |
| ▸ | CA12 known ✓ | O43570 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.43 |
| ▸ | BBOX1 | O75936 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| Potassium Ion SCHEMBL3894341 | 0.94 | MAPT (0.44) | MAPTKDM4EALOX15SMN1; SMN2FFAR3 | |
| SCHEMBL9619043 | 0.89 | MAPT (0.44) | MAPTKDM4EALOX15SMN1; SMN2FFAR3 | |
| SCHEMBL30689662 | 0.84 | KDM4E (0.69) | MAPTKDM4EALOX15SMN1; SMN2FFAR3 | |
| Nitrilotriacetic Acid SCHEMBL93358 | 0.82 | KDM4E (0.59) | MAPTKDM4EALOX15SMN1; SMN2FFAR3 | |
| SCHEMBL20446674 | 0.80 | KDM4E (0.44) | MAPTKDM4EALOX15SMN1; SMN2FFAR3 | |
| Edetic Acid SCHEMBL28981381 | 0.80 | TDP1 (0.56) | MAPTKDM4EALOX15SMN1; SMN2FFAR3 | |
| Nitrilotriacetic Acid SCHEMBL213012 | 0.79 | KDM4E (0.56) | MAPTKDM4EALOX15SMN1; SMN2FFAR3 | |
| Nitrilotriacetic Acid SCHEMBL31195369 | 0.79 | KDM4E (0.56) | MAPTKDM4EALOX15SMN1; SMN2FFAR3 | |
| Nitrilotriacetic Acid SCHEMBL11677912 | 0.79 | KDM4E (0.56) | MAPTKDM4EALOX15SMN1; SMN2FFAR3 | |
| Bicarbonate SCHEMBL10692532 | 0.79 | CA12 (0.43) | FFAR3HDAC3HDAC1HDAC2HDAC8 |
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 353 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117682680-A | Storage-stable methyl glycine-N, N-diacetic acid tri-alkali metal salt composition, preparation method and application thereof | 万华化学集团股份有限公司 | 2024-03-12 | — | — | CN | claimed |
| EP-2625257-B2 | CLEANING EFFICACY OF METAL-SAFE SOLID FOR AUTOMATED INSTRUMENT PROCESSING | ECOLAB USA INC (US) | 2022-11-02 | — | — | EP | claimed |
| CN-109152371-B | Quaternary ammonium disinfectant composition with anionic scale inhibitor | 埃科莱布美国股份有限公司 | 2021-10-26 | — | — | CN | claimed |
| US-10711224-B2 | Compositions and methods useful for removing tablet coatings | ECOLAB USA INC. (US) | 2020-07-14 | — | — | US | claimed |
| EP-2625257-B1 | CLEANING EFFICACY OF METAL-SAFE SOLID FOR AUTOMATED INSTRUMENT PROCESSING | ECOLAB USA INC (US) | 2019-11-20 | — | — | EP | claimed |
| EP-3132015-B1 | COMPOSITIONS AND METHODS USEFUL FOR REMOVING TABLET COATINGS | ECOLAB USA INC (US) | 2019-11-06 | — | — | EP | claimed |
| EP-3079467-B1 | DISINFECTANT CLEANER COMPOSITION HAVING TUBERCULOCIDAL EFFICACY AND EFFICACY AGAINST SPECIFIC VIRUSES | ECOLAB USA INC (US) | 2019-08-07 | — | — | EP | claimed |
| EP-3022280-B1 | MILD ALKALINE SOLID INSTRUMENT CLEANER | ECOLAB USA INC (US) | 2019-01-02 | — | — | EP | claimed |
| EP-3132015-A1 | COMPOSITIONS AND METHODS USEFUL FOR REMOVING TABLET COATINGS | Ecolab Usa Inc. (US) | 2017-02-22 | — | — | EP | claimed |
| US-20170037341-A1 | COMPOSITIONS AND METHODS USEFUL FOR REMOVING TABLET COATINGS | ECOLAB USA INC. | 2017-02-09 | — | — | US | claimed |
| US-20110160350-A1 | REDISPERSIBLE POLYMER POWDERS STABILIZED WITH PROTECTIVE COLLOID COMPOSITIONS | BERGMAN ROGER | 2011-06-30 | — | — | US | claimed |
| US-7811737-B2 | Release fluid additives | XEROX CORPORATION (US) | 2010-10-12 | — | — | US | claimed |
| US-20090041517-A1 | RELEASE FLUID ADDITIVES | XEROX CORPORATION (US) | 2009-02-12 | — | — | US | claimed |
| US-7462661-B2 | Amino or mercapto functional polydimethylsiloxane containing chelating meso-tetraphenylporphyrin, N-(hydroxyethyl)ethylenediaminetriacetic acid, sodium dihydroxyethylglycine, 2,3-dimercapto-1-propanol (oil soluble), or N-(aminoethyl)ethanolamine to chelate metal ions in toner, preventing precipitation | XEROX CORPORATION (US) | 2008-12-09 | — | — | US | claimed |
| US-20070019988-A1 | Release fluid additives | XEROX CORPORATION | 2007-01-25 | — | — | US | claimed |
| US-6686325-B2 | SOIL ROMOVAL, CORROSION RESISTANCE | ECOLAB INC. | 2004-02-03 | — | — | US | claimed |
| WO-2003078691-A2 | ALKALINE SENSITIVE METAL CLEANING COMPOSITION, METHOD FOR CLEANING AN ALKALINE SENSITIVE METAL SURFACE, AND WASHING FACILITY | ECOLAB INC. (US) | 2003-09-25 | — | — | WO | claimed |
| US-20030176305-A1 | Alkaline sensitive metal cleaning composition, method for cleaning an alkaline sensitive metal surface, and washing facility | ECOLAB USA INC. | 2003-09-18 | — | — | US | claimed |
| EP-0846737-B1 | Emulsion ink for stencil printing | RISO KAGAKU CORP (JP) | 2002-11-06 | — | — | EP | claimed |
| US-5705171-A | ODORLESS | THE GILLETTE COMPANY (US) | 1998-01-06 | — | — | US | claimed |