Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKB | Q96GD4 | 3/20 | 0.61 |
| ▸ | AURKA | O14965 | 2/20 | 0.61 |
| ▸ | ACHE | P22303 | 1/20 | 0.61 |
| ▸ | CHEK2 | O96017 | 7/20 | 0.48 |
| ▸ | PARP1 | P09874 | 4/20 | 0.46 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3582849 | 0.96 | AURKB (0.58) | AURKBAURKAACHECHEK2PARP1 | |
| SCHEMBL3574441 | 0.91 | AURKA (0.75) | AURKBAURKAACHECHEK2PARP1 | |
| SCHEMBL3587289 | 0.88 | AURKA (0.56) | AURKBAURKACHEK2PARP1 | |
| SCHEMBL3582854 | 0.88 | AURKB (0.70) | AURKBAURKAACHECHEK2PARP1 | |
| SCHEMBL3580122 | 0.87 | AURKB (0.56) | AURKBAURKAACHECHEK2PARP1 | |
| SCHEMBL6805101 | 0.86 | AURKA (0.64) | AURKBAURKAACHECHEK2PARP1 | |
| SCHEMBL3576982 | 0.85 | AURKA (0.52) | AURKBAURKAACHECHEK2PARP1 | |
| SCHEMBL3580358 | 0.85 | PARP1 (0.53) | AURKBAURKACHEK2PARP1 | |
| SCHEMBL3577227 | 0.84 | AURKA (0.53) | AURKBAURKACHEK2PARP1 | |
| SCHEMBL3585487 | 0.84 | PARP1 (0.54) | AURKBAURKAACHECHEK2PARP1 |
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-7781596-B1 | Substituted 2-phenylbenzimidazoles, the production thereof and their use | ABBOTT LABORATORIES (US) | 2010-08-24 | — | — | US | disclosed |