Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | G6PD | P11413 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | KAT2B | Q92831 | 4/20 | 0.32 |
| ▸ | EP300 | Q09472 | 3/20 | 0.32 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8592692 | 0.76 | ALDH1A1 (0.41) | ALDH1A1G6PDHPGDALOX15HSD17B10 | |
| SCHEMBL8594329 | 0.74 | HSD17B10 (0.47) | ALDH1A1G6PDHPGDALOX15HSD17B10 | |
| SCHEMBL9576668 | 0.71 | ALDH1A1 (0.36) | ALDH1A1G6PDHPGDALOX15HSD17B10 | |
| SCHEMBL9464519 | 0.68 | IDO1 (0.38) | ALDH1A1G6PDHPGDALOX15HSD17B10 | |
| SCHEMBL11201623 | 0.68 | ALDH1A1 (0.38) | ALDH1A1G6PDHPGDALOX15HSD17B10 | |
| SCHEMBL81327 | 0.64 | KAT2B (0.41) | ALDH1A1G6PDHPGDALOX15HSD17B10 | |
| SCHEMBL19240425 | 0.64 | HSD17B10 (0.47) | ALDH1A1G6PDHPGDALOX15HSD17B10 | |
| SCHEMBL9132494 | 0.63 | ALDH1A1 (0.33) | ALDH1A1G6PDHPGDALOX15HSD17B10 | |
| SCHEMBL1535472 | 0.63 | MGLL (0.39) | ALDH1A1HPGDTSHRHIF1AMAPT | |
| SCHEMBL9453147 | 0.62 | ALDH1A1 (0.62) | ALDH1A1G6PDHPGDALOX15HSD17B10 |
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-0816349-A1 | NOVEL CLATHRATE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND COATING COMPOSITION CONTAINING SAID NOVEL CLATHRATE COMPOUND | ROHM AND HAAS COMPANY (US) | 1998-01-07 | — | — | EP | disclosed |