Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK1 | P53350 | 5/20 | 0.69 |
| ▸ | MTOR | P42345 | 1/20 | 0.69 |
| ▸ | VCAM1 | P19320 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.34 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.34 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.34 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.34 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.34 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CCR6 | P51684 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL29653627 | 0.82 | PLK1 (1.00) | PLK1MTORVCAM1CYP1A2CYP3A4 | |
| SCHEMBL5171474 | 0.82 | PLK1 (1.00) | PLK1MTORVCAM1CYP1A2CYP3A4 | |
| SCHEMBL5169861 | 0.79 | PLK1 (0.69) | PLK1MTORCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5171117 | 0.76 | PLK1 (0.71) | PLK1MTORCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL19192207 | 0.74 | PLK1 (0.71) | PLK1MTORVCAM1CYP1A2CYP3A4 | |
| SCHEMBL5172975 | 0.68 | PLK1 (0.41) | PLK1MTORCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5172960 | 0.68 | PLK1 (0.62) | PLK1MTORCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5173246 | 0.66 | PLK1 (0.60) | PLK1MTORCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL28626079 | 0.64 | VCAM1 (0.59) | PLK1MTORVCAM1CYP3A4MAPT | |
| SCHEMBL5173548 | 0.63 | PLK1 (0.71) | PLK1MTORCYP1A2CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1589967-B1 | BENZTHIAZOLE-3 OXIDES USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISORDERS | CYCLACEL LTD (GB) | 2007-05-09 | — | — | EP | claimed |