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 | |
|---|---|---|---|---|
| ▸ | CA2 known ✓ | P00918 | 4/20 | 0.41 |
| ▸ | CA4 known ✓ | P22748 | 1/20 | 0.41 |
| ▸ | CA1 known ✓ | P00915 | 3/20 | 0.40 |
| ▸ | P2RY4 known ✓ | P51582 | 1/20 | 0.36 |
| ▸ | P2RY12 known ✓ | Q9H244 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | PKLR | P30613 | 3/20 | 0.41 |
| ▸ | F2 | P00734 | 2/20 | 0.41 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.41 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.41 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.41 |
| ▸ | MMP1 | P03956 | 2/20 | 0.40 |
| ▸ | MMP2 | P08253 | 2/20 | 0.40 |
| ▸ | MMP9 | P14780 | 2/20 | 0.40 |
| ▸ | MMP8 | P22894 | 2/20 | 0.40 |
| ▸ | MMP13 | P45452 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.38 |
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 SCHEMBL3769154 | 0.96 | ALDH1A1 (0.47) | ALDH1A1KDM4EHPGDCA2CA4 | |
| SCHEMBL3537049 | 0.96 | ALDH1A1 (0.47) | ALDH1A1KDM4EHPGDCA2CA4 | |
| Lithium Ion SCHEMBL2524034 | 0.96 | ALDH1A1 (0.47) | ALDH1A1KDM4EHPGDCA2CA4 | |
| Phenolsulphonic Acid SCHEMBL10535095 | 0.83 | KDM4E (0.69) | ALDH1A1KDM4EHPGDCA2CA4 | |
| SCHEMBL987616 | 0.83 | ALDH1A1 (0.52) | ALDH1A1KDM4EHPGDCA2CA4 | |
| SCHEMBL5016601 | 0.83 | ALDH1A1 (0.52) | ALDH1A1KDM4EHPGDCA2CA4 | |
| SCHEMBL8517045 | 0.83 | KDM4E (0.48) | ALDH1A1KDM4EHPGDCA2PKLR | |
| SCHEMBL38634 | 0.83 | CA1 (0.58) | ALDH1A1KDM4EHPGDCA2CA4 | |
| SCHEMBL7718865 | 0.82 | KDM4E (0.42) | ALDH1A1KDM4EHPGDCA2CA4 | |
| Methane SCHEMBL1304330 | 0.82 | ALDH1A1 (0.50) | ALDH1A1KDM4EHPGDCA2CA4 |
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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7687595-B2 | Sulfonated telechelic polycarbonates | SABIC INNOVATIVE PLASTICS IP B.V. (NL) | 2010-03-30 | — | — | US | claimed |
| US-20090043071-A1 | SULFONATED TELECHELIC POLYCARBONATES | GENERAL ELECTRIC COMPANY (US) | 2009-02-12 | — | — | US | claimed |
| US-20090043069-A1 | ACTIVATED ESTERS FOR SYNTHESIS OF SULFONATED TELECHELIC POLYCARBONATES | GENERAL ELECTRIC COMPANY (US) | 2009-02-12 | — | — | US | claimed |
| WO-2009020967-A1 | ACTIVATED ESTERS FOR SYNTHESIS OF SULFONATED TELECHELIC POLYCARBONATES | SABIC INNOVATIVE PLASTICS IP B.V. (NL) | 2009-02-12 | — | — | WO | claimed |
| WO-2009020966-A1 | SULFONATED TELECHELIC POLYCARBONATES | SABIC INNOVATIVE PLASTICS IP B.V. (NL) | 2009-02-12 | — | — | WO | claimed |
| CN-107405303-A | The aqueous solution of polymer | 陶氏环球技术有限责任公司 | 2017-11-28 | — | — | CN | disclosed |
| CN-105517537-A | Composition for application to mucosa comprising cellulose ether | DOW GLOBAL TECHNOLOGIES INC | 2016-04-20 | — | — | CN | disclosed |
| CN-105358133-A | Composition for application to a mucosa comprising a hydroxyalkyl methylcellulose | DOW GLOBAL TECHNOLOGIES LLC | 2016-02-24 | — | — | CN | disclosed |
| US-9118062-B2 | Anode and method of manufacturing the same, and battery and method of manufacturing the same | SONY CORPORATION (JP) | 2015-08-25 | — | — | US | disclosed |
| US-7875694-B2 | reacting a sulfobenzoic acid cyclic anhydride or sulfobenzoic acid sodium salt with amine functional siloxane; emulsion; useful in a variety of personal, household, healthcare formulations, as well as fabric and textile treatments; produced by a safer route | DOW CORNING CORPORATION (US) | 2011-01-25 | — | — | US | disclosed |
| CN-101939291-A | Derivatives of 4-(2-amino-1-hydroxyethyl)phenol as agonists of the beta2 adrenergic receptor | AMIRALL S A | 2011-01-05 | — | — | CN | disclosed |
| EP-1316578-B1 | Method for producing aqueous dispersion of thermoplastic resin microparticles and toner for electrophotography | DAINIPPON INK & CHEMICALS (JP) | 2010-03-31 | — | — | EP | disclosed |
| WO-2006065467-A2 | SULFONATE FUNCTIONAL ORGANOPOLYSILOXANES | DOW CORNING CORPORATION (US) | 2006-06-22 | — | — | WO | disclosed |
| US-6894090-B2 | Method for producing aqueous dispersion of thermoplastic resin microparticles and toner for electrophotography | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2005-05-17 | — | — | US | disclosed |
| US-20030124448-A1 | Method for producing aqueous dispersion of thermoplastic resin microparticles and toner for electrophotography | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2003-07-03 | — | — | US | disclosed |
| EP-1316578-A1 | Method for producing aqueous dispersion of thermoplastic resin microparticles and toner for electrophotography | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2003-06-04 | — | — | EP | disclosed |
| US-5670476-A | BIODEGRADABLE | THE PROCTER & GAMBLE COMPANY (US) | 1997-09-23 | — | — | US | disclosed |
| US-5451697-A | Carbon dioxide and primary amine | MONSANTO COMPANY (US) | 1995-09-19 | — | — | US | disclosed |
| WO-1995018098-A1 | PROCESS FOR PREPARING ISOCYANATES | MONSANTO COMPANY (US) | 1995-07-06 | — | — | WO | disclosed |
| WO-1992019714-A1 | FABRIC SOFTENER CONTAINING SUBSTITUTED IMIDAZOLINE AND HIGHLY ETHOXYLATED COMPOUNDS | THE PROCTER & GAMBLE COMPANY (US) | 1992-11-12 | — | — | WO | disclosed |