Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 13/20 | 0.41 |
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL5555016 | 0.89 | PDE4A (0.41) | KIF11PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5570876 | 0.79 | PDE4A (0.44) | PDE4APDE4BPDE4CPDE4DTP53 | |
| SCHEMBL12454692 | 0.76 | CACNA2D1 (0.48) | KIF11PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL6525429 | 0.75 | PDE4A (0.51) | KIF11PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5555305 | 0.73 | PDE4A (0.48) | KIF11PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL3838937 | 0.71 | KIF11 (0.40) | KIF11KDM4E | |
| SCHEMBL5100445 | 0.70 | KIF11 (0.62) | KIF11PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL3837879 | 0.70 | MEN1 (0.41) | KIF11KDM4E | |
| SCHEMBL4028286 | 0.69 | MEN1 (0.46) | KIF11KDM4E | |
| SCHEMBL6516746 | 0.69 | POLB (0.39) | KIF11BRD4KDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1517904-A4 | MITOTIC KINESIN INHIBITORS | MERCK & CO INC (US) | 2007-02-21 | — | — | EP | disclosed |
| EP-1517904-A2 | MITOTIC KINESIN INHIBITORS | Merck & Co., Inc. (US) | 2005-03-30 | — | — | EP | disclosed |
| WO-2004039774-A2 | MITOTIC KINESIN INHIBITORS | MERCK & CO., INC. (US) | 2004-05-13 | — | — | WO | disclosed |