Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.47 |
| ▸ | HPGD | P15428 | 5/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | AURKA | O14965 | 4/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.43 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.43 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | RPS27 | P42677 | 1/20 | 0.41 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10976698 | 0.94 | ALDH1A1 (0.62) | ALDH1A1KDM4EHPGDGAAAURKA | |
| SCHEMBL11122384 | 0.91 | ALDH1A1 (0.61) | ALDH1A1KDM4EHPGDGAAAURKA | |
| SCHEMBL9299773 | 0.89 | ALDH1A1 (0.60) | ALDH1A1KDM4EHPGDGAAAURKA | |
| SCHEMBL9324539 | 0.87 | ALDH1A1 (0.57) | ALDH1A1KDM4EHPGDGAAAURKA | |
| SCHEMBL29785489 | 0.86 | ALDH1A1 (0.61) | ALDH1A1KDM4EHPGDGAAAURKA | |
| SCHEMBL1497998 | 0.83 | ALDH1A1 (0.76) | ALDH1A1KDM4EHPGDGAAAURKA | |
| SCHEMBL9324805 | 0.81 | ALDH1A1 (0.55) | ALDH1A1KDM4EHPGDGAAAURKA | |
| SCHEMBL11133237 | 0.81 | ALDH1A1 (0.54) | ALDH1A1KDM4EHPGDGAAAURKA | |
| SCHEMBL10102103 | 0.79 | ALDH1A1 (0.68) | ALDH1A1KDM4EHPGDGAAHSD17B10 | |
| SCHEMBL10985286 | 0.78 | ALDH1A1 (0.57) | ALDH1A1KDM4EHPGDGAAAURKA |
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-4500455-A | RED DYE FOR CELLULOSE | MITSUBISHI CHEMICAL INDUSTRIES, LIMITED (JP) | 1985-02-19 | — | — | US | disclosed |