Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIA1 | P42261 | 1/20 | 0.40 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.40 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.37 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.36 |
| ▸ | AURKA | O14965 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | BCR | P11274 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | DHODH | Q02127 | 1/20 | 0.35 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.35 |
| ▸ | PDE2A | O00408 | 1/20 | 0.35 |
| ▸ | GALR3 | O60755 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2918049 | 0.86 | GRIA1 (0.47) | GRIA1GRIA3PDE4DMCL1ALDH1A1 | |
| Water SCHEMBL4777584 | 0.86 | GRIA1 (0.47) | GRIA1GRIA3PDE4DMCL1ALDH1A1 | |
| SCHEMBL6680176 | 0.85 | LRRK2 (0.44) | GRIA1GRIA3PDE4DMCL1ALDH1A1 | |
| SCHEMBL6686812 | 0.81 | GRIA1 (0.47) | GRIA1GRIA3PDE4DMCL1ALDH1A1 | |
| SCHEMBL6674051 | 0.81 | PARP1 (0.39) | GRIA1GRIA3PDE4DMCL1LRRK2 | |
| SCHEMBL1882884 | 0.80 | GRIA1 (0.47) | GRIA1GRIA3PDE4DMCL1ALDH1A1 | |
| SCHEMBL6692587 | 0.79 | CTSL (0.40) | GRIA1GRIA3PDE4DAURKAALDH1A1 | |
| SCHEMBL4562988 | 0.79 | ADORA2A (0.39) | GRIA1GRIA3PDE4DALDH1A1KDM4E | |
| SCHEMBL6691807 | 0.78 | PTGS2 (0.43) | GRIA1GRIA3PDE4D | |
| SCHEMBL6698453 | 0.78 | GRIA1 (0.47) | GRIA1GRIA3PDE4DMCL1ALDH1A1 |
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-1465626-A2 | PHARMACEUTICAL COMPOSITIONS COMPRISING DIHYDROPYRIDINONE COMPOUNDS AND AN IMMUNOREGULATORY OR AN ANTIINFLAMMATORY AGENT AND THEIR USES | Eisai Co., Ltd. (JP) | 2004-10-13 | — | — | EP | disclosed |
| WO-2003047577-A2 | PHARMACEUTICAL COMPOSITIONS COMPRISING DIHYDROPYRIDINONE COMPOUNDS AND AN IMMUNOREGULATORY OR AN ANTIINFLAMMATORY AGENT AND THEIR USES | EISAI CO LTD (JP) | 2003-06-12 | — | — | WO | disclosed |