Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HINT1 | P49773 | 2/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.31 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.31 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.31 |
| ▸ | ADK | P55263 | 1/20 | 0.31 |
| ▸ | NT5E | P21589 | 1/20 | 0.30 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9681390 | 0.75 | HINT1 (0.51) | HINT1ADORA3ADORA1ADORA2BHSP90B1 | |
| SCHEMBL9681406 | 0.73 | HINT1 (0.42) | HINT1ADORA3ADORA1ADORA2BHSP90B1 | |
| SCHEMBL9683203 | 0.71 | P2RY1 (0.40) | HINT1NT5E | |
| SCHEMBL9683196 | 0.71 | P2RY1 (0.40) | HINT1NT5E | |
| SCHEMBL28389019 | 0.71 | CYP2C19 (0.40) | HSP90AA1HSP90AB1ADORA3ADORA1ADORA2B | |
| SCHEMBL11459664 | 0.67 | PI4KA (0.48) | ADORA3ADORA1ADORA2BADORA2A | |
| SCHEMBL8529428 | 0.67 | HINT1 (0.61) | HINT1ADORA3ADORA1ADORA2BNT5E | |
| SCHEMBL769466 | 0.66 | HSP90AA1 (0.39) | HSP90AA1HSP90AB1ADORA3ADORA1ADORA2B | |
| SCHEMBL769467 | 0.66 | HSP90AA1 (0.39) | HSP90AA1HSP90AB1ADORA3ADORA1ADORA2B | |
| SCHEMBL8530562 | 0.66 | HINT1 (0.62) | HINT1ADORA3ADORA1ADORA2BNT5E |
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-5153318-A | Viricides for hepatitis and human t-cell leukemia/lymphoma viruses | BURROUGHS WELLCOME CO. (US) | 1992-10-06 | — | — | US | disclosed |