Known targets — ChEMBL curated mechanism
ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Ethylene Glycol. 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 | 11/20 | 0.48 |
| ▸ | CA2 known ✓ | P00918 | 11/20 | 0.48 |
| ▸ | CA12 known ✓ | O43570 | 4/20 | 0.41 |
| ▸ | CA4 known ✓ | P22748 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 4/20 | 0.70 |
| ▸ | RECQL | P46063 | 2/20 | 0.70 |
| ▸ | GLA | P06280 | 1/20 | 0.70 |
| ▸ | HPGD | P15428 | 1/20 | 0.70 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.70 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.70 |
| ▸ | BLM | P54132 | 1/20 | 0.70 |
| ▸ | CA9 | Q16790 | 9/20 | 0.42 |
| ▸ | CA7 | P43166 | 4/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.41 |
| ▸ | CA3 | P07451 | 2/20 | 0.41 |
| ▸ | CA6 | P23280 | 2/20 | 0.41 |
| ▸ | CA5A | P35218 | 2/20 | 0.41 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Ether SCHEMBL11127068 | 0.93 | TSHR (0.61) | TSHRRECQLGLAHPGDMAPK1 | |
| Ethylene Glycol SCHEMBL6838996 | 0.92 | RECQL (0.85) | TSHRRECQLGLAHPGDMAPK1 | |
| SCHEMBL302087 | 0.91 | TSHR (0.83) | TSHRRECQLGLAHPGDMAPK1 | |
| Ethylene Glycol SCHEMBL18039046 | 0.89 | RECQL (0.79) | TSHRRECQLGLAHPGDMAPK1 | |
| Fluoride SCHEMBL28262916 | 0.87 | TSHR (0.76) | TSHRRECQLGLAHPGDMAPK1 | |
| Lithium Ion SCHEMBL17456624 | 0.87 | TSHR (0.75) | TSHRRECQLGLAHPGDMAPK1 | |
| SCHEMBL2634750 | 0.87 | — | — | |
| SCHEMBL17456497 | 0.87 | TSHR (0.75) | TSHRRECQLGLAHPGDMAPK1 | |
| Potassium Ion SCHEMBL6534824 | 0.87 | TSHR (0.75) | TSHRRECQLGLAHPGDMAPK1 | |
| Zinc Ion SCHEMBL31471926 | 0.87 | TSHR (0.75) | TSHRRECQLGLAHPGDMAPK1 |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107693520-A | A kind of dietary supplements and its preparation method and application | 阳光医疗运营有限公司 | 2018-02-16 | — | — | CN | disclosed |
| CN-104902864-A | Cosmetic composition | OREAL | 2015-09-09 | — | — | CN | disclosed |
| CN-102762620-B | Polymers and use thereof as dispersants having a foam-inhibiting effect | CLARIANT FINANCE BVI LTD | 2015-04-01 | — | — | CN | disclosed |
| CN-102762620-A | Polymers and use thereof as dispersants having a foam-inhibiting effect | CLARIANT FINANCE BVI LTD | 2012-10-31 | — | — | CN | disclosed |
| CN-101400749-B | Water-based pigment preparation | CLARIANT FINANCE BVI LTD | 2012-09-26 | — | — | CN | disclosed |
| CN-101622320-B | Aqueous pigment preparations | CLARIANT FINANCE BVI LTD | 2012-07-18 | — | — | CN | disclosed |
| CN-101622320-A | Aqueous pigment preparations | CLARIANT INT LTD | 2010-01-06 | — | — | CN | disclosed |
| CN-101400749-A | Water-based pigment preparation | CLARIANT INT LTD (CH) | 2009-04-01 | — | — | CN | disclosed |
| CN-1237071-C | Conjugates of phytosterol or phytostanol with ascorbic acid and use thereof in treating or preventing cardiovascular disease | FORBES MEDI TECH INC (CA) | 2006-01-18 | — | — | CN | disclosed |
| CN-1643076-A | Water-soluble yellow azo dyes | CLARIANT GMBH (DE) | 2005-07-20 | — | — | CN | disclosed |
| CN-1505665-A | Colorant combinations | 科莱恩有限公司 | 2004-06-16 | — | — | CN | disclosed |
| CN-1370179-A | Aromatic and heterocyclic derivatives of phytosterols and/or phytostanols for use in the treatment or prevention of cardiovascular disease | FORBES MEDI TECH INC (CA) | 2002-09-18 | — | — | CN | disclosed |
| CN-1370180-A | Conjugates of phytosterol or phytostanol with ascorbic acid and use thereof in treating or preventing cardiovascular disease | FORBES MEDI TECH INC (CA) | 2002-09-18 | — | — | CN | disclosed |
| US-6365601-B1 | CONTACTING THE FRUIT OF PIPER SPECIES WITH AQUEOUS HYDROTROPE SOLUTION; SEPARATING THE SOLUTION FROM THE SOLID RESIDUE; AND RECOVERING PIPERINE FROM THE SOLUTION BY A METHOD SELECTED FROM A GROUP CONSISTING OF DILUTION AND SOLVENT EXTRACTION | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2002-04-02 | — | — | US | disclosed |
| US-6224877-B1 | PLANT EXTRACTS | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2001-05-01 | — | — | US | disclosed |