Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 14/20 | 0.56 |
| ▸ | AURKB | Q96GD4 | 4/20 | 0.55 |
| ▸ | PKN1 | Q16512 | 3/20 | 0.55 |
| ▸ | PKN2 | Q16513 | 3/20 | 0.55 |
| ▸ | PRKD3 | O94806 | 2/20 | 0.55 |
| ▸ | PIM1 | P11309 | 2/20 | 0.55 |
| ▸ | CLK2 | P49760 | 2/20 | 0.55 |
| ▸ | GSK3A | P49840 | 2/20 | 0.55 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.55 |
| ▸ | PIM3 | Q86V86 | 2/20 | 0.55 |
| ▸ | PRKD2 | Q9BZL6 | 2/20 | 0.55 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.55 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.55 |
| ▸ | STK17A | Q9UEE5 | 2/20 | 0.55 |
| ▸ | PLK4 | O00444 | 1/20 | 0.55 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.55 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.55 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.55 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.55 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL6810101 | 0.89 | AURKB (0.54) | PARP1AURKBPKN1PKN2PRKD3 | |
| SCHEMBL6801983 | 0.88 | AURKB (0.68) | PARP1AURKBPKN1PKN2PRKD3 | |
| SCHEMBL6586196 | 0.85 | BRD4 (0.44) | PARP1PRKCZPARP2 | |
| SCHEMBL6805695 | 0.85 | AURKB (0.66) | PARP1AURKBPKN1PKN2PRKD3 | |
| SCHEMBL6805989 | 0.84 | PARP1 (0.38) | PARP1AURKBPRKD3PIM1CLK2 | |
| SCHEMBL6810111 | 0.81 | PARP1 (0.57) | PARP1AURKBPKN1PKN2PRKD3 | |
| SCHEMBL6806262 | 0.80 | AURKB (0.57) | PARP1AURKBPKN1PKN2PRKD3 | |
| SCHEMBL6806427 | 0.78 | PKN1 (0.67) | PARP1AURKBPKN1PKN2PRKD3 | |
| SCHEMBL3587286 | 0.78 | AURKA (0.76) | PARP1AURKBPARP2DHODHAURKA | |
| SCHEMBL5620745 | 0.77 | PARP1 (0.74) | PARP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6696437-B1 | Heterocyclically substituted benzimidazoles, the production and application thereof | ABBOTT GMBH & CO. KG (DE) | 2004-02-24 | — | — | US | disclosed |