Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKB | Q96GD4 | 3/20 | 0.85 |
| ▸ | KDR | P35968 | 2/20 | 0.85 |
| ▸ | PARP1 | P09874 | 16/20 | 0.68 |
| ▸ | AURKA | O14965 | 2/20 | 0.66 |
| ▸ | DHODH | Q02127 | 2/20 | 0.58 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL3582335 | 0.92 | AURKB (0.84) | AURKBKDRPARP1AURKADHODH | |
| SCHEMBL3577924 | 0.92 | AURKB (1.00) | AURKBKDRPARP1AURKADHODH | |
| SCHEMBL3580117 | 0.88 | AURKB (0.77) | AURKBKDRPARP1AURKADHODH | |
| SCHEMBL6581347 | 0.87 | AURKB (0.65) | AURKBKDRPARP1AURKADHODH | |
| SCHEMBL3578629 | 0.86 | AURKB (0.64) | AURKBKDRPARP1AURKADHODH | |
| SCHEMBL3582141 | 0.85 | AURKB (0.75) | AURKBKDRPARP1DHODHCHEK2 | |
| SCHEMBL3585484 | 0.85 | PARP1 (0.75) | AURKBKDRPARP1AURKADHODH | |
| SCHEMBL7137128 | 0.82 | PARP1 (1.00) | AURKBKDRPARP1AURKADHODH | |
| SCHEMBL29179976 | 0.81 | PARP1 (0.85) | AURKBKDRPARP1AURKADHODH | |
| SCHEMBL29179971 | 0.81 | PARP1 (1.00) | AURKBKDRPARP1AURKADHODH |
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 |