Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.65 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.65 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.65 |
| ▸ | TSHR | P16473 | 1/20 | 0.65 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 3/20 | 0.45 |
| ▸ | CA12 | O43570 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.45 |
| ▸ | CA4 | P22748 | 2/20 | 0.45 |
| ▸ | CA9 | Q16790 | 2/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.45 |
| ▸ | CASP6 | P55212 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | ELAVL1 | Q15717 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11054080 | 0.84 | TSHR (0.79) | ALDH1A1HSD17B10TDP1TSHRLMNA | |
| SCHEMBL30991368 | 0.84 | ALDH1A1 (0.48) | ALDH1A1HSD17B10TDP1LMNACA1 | |
| SCHEMBL342586 | 0.84 | ALDH1A1 (0.48) | ALDH1A1HSD17B10TDP1LMNACA1 | |
| SCHEMBL28309907 | 0.83 | ALDH1A1 (0.76) | ALDH1A1HSD17B10TDP1TSHRLMNA | |
| Water SCHEMBL27981523 | 0.82 | ALDH1A1 (0.47) | ALDH1A1HSD17B10TDP1LMNACA1 | |
| Methylamine SCHEMBL27432354 | 0.82 | ALDH1A1 (0.47) | ALDH1A1HSD17B10TDP1LMNACA1 | |
| SCHEMBL3864762 | 0.81 | ALDH1A1 (0.73) | ALDH1A1HSD17B10TDP1TSHRLMNA | |
| SCHEMBL1655356 | 0.80 | TSHR (1.00) | ALDH1A1HSD17B10TDP1TSHRLMNA | |
| SCHEMBL29044 | 0.80 | TSHR (1.00) | ALDH1A1HSD17B10TDP1TSHRLMNA | |
| SCHEMBL7814607 | 0.79 | ALDH1A1 (0.65) | ALDH1A1HSD17B10TDP1TSHRLMNA |
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-5175261-A | Useful for coloring cellulose materials, animal furs or leather | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-12-29 | — | — | US | disclosed |