Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADK | P55263 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.31 |
| ▸ | PARP1 | P09874 | 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 | |
|---|---|---|---|---|
| SCHEMBL15756771 | 0.79 | DPP4 (0.41) | ADK | |
| SCHEMBL1741363 | 0.78 | ADORA2A (0.46) | ADKADORA3ADORA1 | |
| SCHEMBL17815691 | 0.78 | RIPK1 (0.44) | PARP1 | |
| SCHEMBL15756598 | 0.76 | ALDH1A1 (0.43) | ADORA3ADORA1 | |
| SCHEMBL30747788 | 0.75 | GDA (0.33) | — | |
| SCHEMBL27249496 | 0.75 | GDA (0.33) | — | |
| SCHEMBL28084733 | 0.72 | TLR9 (0.47) | ADORA3ADORA1 | |
| SCHEMBL22019266 | 0.70 | L3MBTL1 (0.37) | — | |
| SCHEMBL11004734 | 0.69 | LMNA (0.46) | ADORA1 | |
| SCHEMBL7821784 | 0.69 | ALDH1A1 (0.42) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1940843-A2 | UNSATURATED HETEROCYCLIC DERIVATIVES | ARIAD PHARMACEUTICALS, INC. (US) | 2008-07-09 | — | — | EP | disclosed |
| WO-2007021937-A2 | UNSATURATED HETEROCYCLIC DERIVATIVES | ARIAD PHARMACEUTICALS, INC. (US) | 2007-02-22 | — | — | WO | disclosed |