Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.44 |
| ▸ | FLT3 | P36888 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | TGM2 | P21980 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | PDE4A | P27815 | 1/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.41 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16953254 | 0.85 | CYP3A4 (0.40) | POLBMAPTHTTNPSR1TGM2 | |
| SCHEMBL12328328 | 0.81 | KDM4E (0.50) | POLBMAPTHTTNPSR1NPC1 | |
| SCHEMBL14466515 | 0.81 | ALDH1A1 (0.58) | POLBMAPTHTTNPSR1NPC1 | |
| SCHEMBL13469239 | 0.81 | SMN1; SMN2 (0.57) | POLBMAPTNPC1RAB9AHSD17B10 | |
| SCHEMBL7941437 | 0.79 | CYP3A4 (0.43) | POLBMAPTHTTNPSR1NPC1 | |
| SCHEMBL16238926 | 0.79 | POLB (0.45) | POLBMAPTHTTNPSR1NPC1 | |
| SCHEMBL6350154 | 0.79 | ABCG2 (0.67) | ABCG2POLBMAPTHTTNPSR1 | |
| SCHEMBL13469244 | 0.79 | KDM4E (0.58) | POLBMAPTHTTNPSR1NPC1 | |
| SCHEMBL30938830 | 0.79 | MAPT (0.57) | MAPTHTTNPC1RAB9AHSD17B10 | |
| SCHEMBL16951695 | 0.79 | CYP3A4 (0.46) | POLBMAPTHTTNPSR1NPC1 |
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-2007084415-A2 | COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS | SCHERING CORPORATION (US) | 2007-07-26 | — | — | WO | disclosed |