Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.67 |
| ▸ | TSHR | P16473 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | MMP8 | P22894 | 1/20 | 0.37 |
| ▸ | MMP14 | P50281 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 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 | |
|---|---|---|---|---|
| Diethylene Glycol Monoethyl Ether SCHEMBL7771153 | 0.96 | ALDH1A1 (0.62) | ALDH1A1TSHRLMNACYP3A4MEN1 | |
| Ether SCHEMBL815686 | 0.88 | ALDH1A1 (0.78) | ALDH1A1TSHRLMNACYP3A4TDP1 | |
| SCHEMBL1668385 | 0.87 | ALDH1A1 (0.64) | ALDH1A1TSHRLMNACYP3A4MEN1 | |
| Butoxyethanol SCHEMBL17162908 | 0.87 | ALDH1A1 (0.64) | ALDH1A1TSHRLMNACYP3A4MEN1 | |
| Di(Hydroxyethyl)Ether SCHEMBL7771146 | 0.84 | CYP3A4 (0.54) | ALDH1A1TSHRLMNACYP3A4MEN1 | |
| SCHEMBL27929287 | 0.82 | ALDH1A1 (0.75) | ALDH1A1TSHRLMNACYP3A4MEN1 | |
| Ethylene Glycol SCHEMBL8663623 | 0.82 | ALDH1A1 (0.90) | ALDH1A1TSHRLMNACYP3A4MEN1 | |
| SCHEMBL9492501 | 0.82 | — | — | |
| SCHEMBL6249719 | 0.82 | ALDH1A1 (1.00) | ALDH1A1TSHRLMNACYP3A4MEN1 | |
| SCHEMBL8420801 | 0.82 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2444846-B1 | Method for rebalancing a multicomponent solvent solution | DU PONT (US) | 2015-04-22 | — | — | EP | disclosed |
| US-8349185-B2 | Method for rebalancing a multicomponent solvent solution | E I DU PONT DE NEMOURS AND COMPANY (US) | 2013-01-08 | — | — | US | disclosed |
| US-20120100489-A1 | METHOD FOR REBALANCING A MULTICOMPONENT SOLVENT SOLUTION | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2012-04-26 | — | — | US | disclosed |
| EP-2444846-A2 | Method for rebalancing a multicomponent solvent solution | E. I. du Pont de Nemours and Company (US) | 2012-04-25 | — | — | EP | disclosed |