Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | LPL | P06858 | 1/20 | 0.35 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.34 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA9 | Q16790 | 2/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | PKLR | P30613 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10034427 | 0.92 | ALDH1A1 (0.46) | ALDH1A1HPGDCYP3A4HSD17B10LPL | |
| SCHEMBL17574426 | 0.88 | CYP17A1 (0.38) | ALDH1A1ESR2CA12CA1CA2 | |
| SCHEMBL21386483 | 0.88 | ALDH1A1 (0.54) | ALDH1A1HPGDCYP3A4HSD17B10LPL | |
| SCHEMBL14316663 | 0.88 | ALDH1A1 (0.42) | ALDH1A1HPGDCYP3A4HSD17B10LPL | |
| SCHEMBL16366595 | 0.85 | ALDH1A1 (0.50) | ALDH1A1HPGDCYP3A4HSD17B10LPL | |
| SCHEMBL16366131 | 0.85 | ALDH1A1 (0.50) | ALDH1A1HPGDCYP3A4HSD17B10LPL | |
| SCHEMBL31504664 | 0.84 | ALDH1A1 (0.45) | ALDH1A1HPGDCYP3A4HSD17B10LPL | |
| SCHEMBL29829158 | 0.84 | ALDH1A1 (0.45) | ALDH1A1HPGDCYP3A4HSD17B10LPL | |
| SCHEMBL16017144 | 0.84 | ALDH1A1 (0.45) | ALDH1A1HPGDCYP3A4HSD17B10LPL | |
| SCHEMBL17574427 | 0.84 | CA12 (0.44) | ALDH1A1SLC6A2SLC6A4SLC6A3CA12 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2415752-B1 | AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME | IDEMITSU KOSAN CO (JP) | 2016-03-09 | — | — | EP | disclosed |