Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | DAO | P14920 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8955030 | 0.97 | GPR84 (0.44) | GPR84MAOADRD2DRD4DRD3 | |
| SCHEMBL7529367 | 0.89 | GPR84 (0.35) | GPR84MAOADRD2DRD4DRD3 | |
| SCHEMBL214012 | 0.89 | GPR84 (0.56) | GPR84HRH3 | |
| SCHEMBL10807345 | 0.89 | DAO (0.40) | GPR84MAOADRD2DRD4DRD3 | |
| SCHEMBL4687381 | 0.89 | GPR84 (0.35) | GPR84MAOADRD2DRD4DRD3 | |
| SCHEMBL3145124 | 0.89 | GPR84 (0.35) | GPR84MAOADRD2DRD4DRD3 | |
| SCHEMBL6684198 | 0.89 | GPR84 (0.39) | GPR84MAOADRD2DRD4DRD3 | |
| SCHEMBL4623787 | 0.89 | HRH3 (0.47) | MAOAHRH3 | |
| SCHEMBL7172295 | 0.88 | MAOA (0.42) | MAOADRD2DRD4DRD3DAO | |
| SCHEMBL25406384 | 0.87 | DAO (0.39) | GPR84MAOADAO |
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-1337511-A1 | BIS-HETEROCYCLIC COMPOUNDS WITH ANTITUMOUR AND CHEMOSENSITISING ACTIVITY | Sigma-Tau Industrie Farmaceutiche Riunite S.p.A. (IT) | 2003-08-27 | — | — | EP | disclosed |
| WO-2002036561-A1 | BIS-HETEROCYCLIC COMPOUNDS WITH ANTITUMOUR AND CHEMOSENSITISING ACTIVITY | SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) | 2002-05-10 | — | — | WO | disclosed |