Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL12520053 | 0.96 | ALDH1A1 (0.53) | ALDH1A1HSD17B10SMN1; SMN2POLBATM | |
| SCHEMBL18016684 | 0.81 | CYP1A2 (0.46) | ALDH1A1SMN1; SMN2POLBL3MBTL1KMT2A | |
| SCHEMBL3549604 | 0.79 | ALDH1A1 (0.36) | ALDH1A1HSD17B10SMN1; SMN2POLBATM | |
| SCHEMBL14654286 | 0.79 | L3MBTL1 (0.52) | ALDH1A1HSD17B10SMN1; SMN2POLBL3MBTL1 | |
| SCHEMBL15440675 | 0.79 | CA2 (0.42) | ALDH1A1HSD17B10SMN1; SMN2POLBKMT2A | |
| SCHEMBL12767515 | 0.78 | HSD11B1 (0.47) | ALDH1A1POLBL3MBTL1MEN1KMT2A | |
| SCHEMBL6599392 | 0.77 | SMN1; SMN2 (0.50) | ALDH1A1HSD17B10SMN1; SMN2POLBATM | |
| SCHEMBL8311633 | 0.77 | ATM (0.56) | ALDH1A1HSD17B10SMN1; SMN2POLBATM | |
| SCHEMBL18016176 | 0.76 | ALDH1A1 (0.37) | ALDH1A1HSD17B10SMN1; SMN2POLBATM | |
| SCHEMBL12385779 | 0.76 | ALDH1A1 (0.63) | ALDH1A1HSD17B10SMN1; SMN2POLBMEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0008802-B1 | ERGOLINE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC COMPOSITION CONTAINING THEM | FARMITALIA CARLO ERBA S.p.A. (IT) | 1982-07-21 | — | — | EP | disclosed |
| US-4321381-A | Ergot derivatives | FARMITALIA CARLO ERBA S.P.A. (IT) | 1982-03-23 | — | — | US | disclosed |
| US-4252941-A | HYPOTENSIVE AGENTS, ANTIPROLACTINIC AGENTS | FARMITALIA CARLO ERBA S.P.A. (IT) | 1981-02-24 | — | — | US | disclosed |
| EP-0008802-A1 | Ergoline derivatives, their preparation and therapeutic composition containing them | FARMITALIA CARLO ERBA S.p.A. (IT) | 1980-03-19 | — | — | EP | disclosed |