Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKB | Q96GD4 | 2/20 | 0.49 |
| ▸ | KDR | P35968 | 1/20 | 0.49 |
| ▸ | PARP1 | P09874 | 16/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.37 |
| ▸ | ELANE | P08246 | 1/20 | 0.35 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
| ▸ | DHODH | Q02127 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3586255 | 0.91 | KDR (0.41) | AURKBKDRPARP1KCNH2MCHR1 | |
| SCHEMBL3577370 | 0.86 | KDR (0.65) | AURKBKDRPARP1DHODH | |
| SCHEMBL3582143 | 0.84 | AURKB (0.56) | AURKBKDRPARP1AURKADHODH | |
| SCHEMBL3580644 | 0.79 | AURKB (0.76) | AURKBKDRPARP1AURKADHODH | |
| SCHEMBL3578629 | 0.79 | AURKB (0.64) | AURKBKDRPARP1AURKADHODH | |
| SCHEMBL3582340 | 0.78 | AURKB (0.63) | AURKBKDRPARP1AURKADHODH | |
| SCHEMBL3586249 | 0.78 | KDR (0.54) | AURKBKDRPARP1DHODH | |
| SCHEMBL6580677 | 0.77 | KDR (0.49) | AURKBKDRPARP1DHODH | |
| SCHEMBL3581925 | 0.77 | AURKB (0.47) | AURKBKDRPARP1AURKADHODH | |
| SCHEMBL3580139 | 0.75 | AURKB (0.46) | AURKBKDRPARP1DHODH |
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 |