Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKB | Q96GD4 | 3/20 | 1.00 |
| ▸ | KDR | P35968 | 2/20 | 1.00 |
| ▸ | PARP1 | P09874 | 17/20 | 0.77 |
| ▸ | DHODH | Q02127 | 4/20 | 0.66 |
| ▸ | AURKA | O14965 | 2/20 | 0.55 |
| ▸ | PARP2 | Q9UGN5 | 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 | |
|---|---|---|---|---|
| SCHEMBL3578622 | 0.92 | AURKB (0.85) | AURKBKDRPARP1DHODHAURKA | |
| SCHEMBL3582335 | 0.91 | AURKB (0.84) | AURKBKDRPARP1DHODHAURKA | |
| SCHEMBL7139308 | 0.88 | PARP1 (1.00) | AURKBKDRPARP1DHODHAURKA | |
| SCHEMBL6584126 | 0.87 | AURKB (0.77) | AURKBKDRPARP1DHODHAURKA | |
| SCHEMBL7137128 | 0.86 | PARP1 (1.00) | AURKBKDRPARP1DHODHAURKA | |
| SCHEMBL3580644 | 0.86 | AURKB (0.76) | AURKBKDRPARP1DHODHAURKA | |
| SCHEMBL3582141 | 0.86 | AURKB (0.75) | AURKBKDRPARP1DHODHPARP2 | |
| SCHEMBL7141417 | 0.81 | PARP1 (1.00) | AURKBKDRPARP1DHODHAURKA | |
| SCHEMBL3585484 | 0.80 | PARP1 (0.75) | AURKBKDRPARP1DHODHAURKA | |
| SCHEMBL7135390 | 0.80 | PARP1 (0.81) | AURKBKDRPARP1DHODHAURKA |
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 |