Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | XDH | P47989 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | APP | P05067 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | FBP1 | P09467 | 1/20 | 0.36 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.36 |
| ▸ | GCGR | P47871 | 1/20 | 0.36 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7261320 | 0.83 | MEN1 (0.45) | ADORA3ADORA2AADORA1KDM4EALDH1A1 | |
| SCHEMBL7261235 | 0.80 | LTA4H (0.46) | ADORA2AADORA1KDM4EALDH1A1MAPT | |
| SCHEMBL10827533 | 0.80 | ADORA2A (0.52) | ADORA2AADORA1XDHKDM4EALDH1A1 | |
| SCHEMBL4839060 | 0.76 | KDM4E (0.48) | ADORA3ADORA2AADORA2BADORA1KDM4E | |
| SCHEMBL7022256 | 0.76 | PGR (0.47) | XDHGAAAR | |
| SCHEMBL31298734 | 0.73 | ADORA3 (0.44) | ADORA3ADORA2AADORA2BADORA1XDH | |
| SCHEMBL27195567 | 0.71 | ADORA3 (0.54) | ADORA3ADORA2AADORA2BADORA1XDH | |
| SCHEMBL3452020 | 0.70 | HSP90AA1 (0.64) | ADORA3ADORA2AADORA2BADORA1KDM4E | |
| SCHEMBL7702979 | 0.70 | DYRK1A (0.46) | ADORA3APP | |
| SCHEMBL3451442 | 0.69 | ADORA3 (0.44) | ADORA3ADORA2AADORA2BADORA1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003084937-A2 | PYRIMIDINEDIONE DERIVATIVES USEFUL FOR THE TREATMENT OF INFLAMMATION AND IMMUNOLOGICAL DISEASES | ORCHID CHEMICALS & PHARMACEUTICALS LIMITED (IN) | 2003-10-16 | — | — | WO | disclosed |