Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL643893 | 0.77 | HRH3 (0.48) | HRH3SMN1; SMN2 | |
| SCHEMBL7225776 | 0.77 | HRH3 (0.54) | HRH3SMN1; SMN2 | |
| SCHEMBL4676098 | 0.73 | HRH3 (0.36) | HRH3SMN1; SMN2 | |
| SCHEMBL1400000 | 0.72 | HRH3 (0.43) | HRH3SMN1; SMN2 | |
| SCHEMBL7543987 | 0.70 | CXCR4 (0.53) | HRH3SMN1; SMN2 | |
| SCHEMBL5419101 | 0.70 | KEAP1 (0.47) | HRH3KEAP1SMN1; SMN2 | |
| SCHEMBL8387297 | 0.68 | L3MBTL1 (0.53) | SMN1; SMN2 | |
| SCHEMBL4714661 | 0.68 | — | — | |
| SCHEMBL13876470 | 0.67 | SMN1; SMN2 (0.61) | HRH3KEAP1SMN1; SMN2 | |
| SCHEMBL6276732 | 0.67 | — | — |
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-0590272-A2 | 17B-Aryl and 17B-heterocyclyl-5-beta,14-beta-andostane derivatives active on the cardiovascular system, processes for their preparation and pharmaceutical compositions containing same | Sigma-Tau Industrie Farmaceutiche Riunite S.p.A. (IT) | 1994-04-06 | — | — | EP | disclosed |