Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.78 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | THRB | P10828 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | PPARD | Q03181 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| 2-Ethoxyethanol SCHEMBL8584475 | 1.00 | ALDH1A1 (0.78) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| 2-Ethoxyethanol SCHEMBL1184725 | 1.00 | ALDH1A1 (0.78) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| Diethylene Glycol Monoethyl Ether SCHEMBL9789370 | 0.95 | ALDH1A1 (0.70) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| Triethylene Glycol SCHEMBL21811317 | 0.95 | ALDH1A1 (0.70) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| 2-Ethoxyethanol SCHEMBL10804467 | 0.95 | ALDH1A1 (0.70) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| Diethylene Glycol Monoethyl Ether SCHEMBL10946555 | 0.95 | ALDH1A1 (0.70) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| 2-Methoxyethanol SCHEMBL29208297 | 0.94 | ALDH1A1 (0.68) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| 2-Ethoxyethanol SCHEMBL17785986 | 0.94 | ALDH1A1 (0.78) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| Di(Hydroxyethyl)Ether SCHEMBL9045837 | 0.92 | ALDH1A1 (0.65) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| 2-Methoxyethanol SCHEMBL9045843 | 0.92 | ALDH1A1 (0.65) | ALDH1A1TSHRMAPK1MEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4094844-A | Water-borne epoxy resin coating compositions | SHELL OIL COMPANY (US) | 1978-06-13 | — | — | US | disclosed |