Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKB | Q96GD4 | 4/20 | 0.63 |
| ▸ | KDR | P35968 | 3/20 | 0.63 |
| ▸ | PARP1 | P09874 | 12/20 | 0.58 |
| ▸ | PARP2 | Q9UGN5 | 3/20 | 0.49 |
| ▸ | PARP3 | Q9Y6F1 | 2/20 | 0.49 |
| ▸ | AURKA | O14965 | 2/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | DHODH | Q02127 | 1/20 | 0.42 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.39 |
| ▸ | PIM1 | P11309 | 1/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.39 |
| ▸ | FLT4 | P35916 | 1/20 | 0.39 |
| ▸ | CLK2 | P49760 | 1/20 | 0.39 |
| ▸ | GSK3A | P49840 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3578629 | 0.92 | AURKB (0.64) | AURKBKDRPARP1PARP2PARP3 | |
| SCHEMBL3580644 | 0.91 | AURKB (0.76) | AURKBKDRPARP1PARP2PARP3 | |
| SCHEMBL3582335 | 0.87 | AURKB (0.84) | AURKBKDRPARP1PARP2PARP3 | |
| SCHEMBL3582143 | 0.85 | AURKB (0.56) | AURKBKDRPARP1PARP2AURKA | |
| SCHEMBL3587289 | 0.82 | AURKA (0.56) | AURKBPARP1PARP2AURKACHEK1 | |
| SCHEMBL3580122 | 0.81 | AURKB (0.56) | AURKBKDRPARP1AURKA | |
| SCHEMBL3578622 | 0.79 | AURKB (0.85) | AURKBKDRPARP1AURKADHODH | |
| SCHEMBL3577227 | 0.78 | AURKA (0.53) | AURKBPARP1PARP2AURKACHEK1 | |
| SCHEMBL3582780 | 0.78 | AURKB (0.49) | AURKBKDRPARP1AURKADHODH | |
| SCHEMBL6581349 | 0.78 | AURKB (0.64) | AURKBKDRPARP1PARP2PARP3 |
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 |