Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKB | Q96GD4 | 4/20 | 0.53 |
| ▸ | AURKA | O14965 | 3/20 | 0.53 |
| ▸ | KDR | P35968 | 2/20 | 0.53 |
| ▸ | PARP1 | P09874 | 9/20 | 0.49 |
| ▸ | CHEK2 | O96017 | 3/20 | 0.41 |
| ▸ | DHODH | Q02127 | 1/20 | 0.41 |
| ▸ | CSF1R | P07333 | 1/20 | 0.40 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 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 | |
|---|---|---|---|---|
| SCHEMBL6801881 | 0.98 | AURKB (0.51) | AURKBAURKAKDRPARP1CHEK2 | |
| SCHEMBL6806075 | 0.95 | AURKB (0.51) | AURKBAURKAKDRPARP1CHEK2 | |
| SCHEMBL6806368 | 0.93 | AURKB (0.49) | AURKBAURKAKDRPARP1CHEK2 | |
| SCHEMBL6807309 | 0.90 | AURKB (0.47) | AURKBAURKAKDRPARP1DHODH | |
| SCHEMBL6806241 | 0.88 | AURKB (0.43) | AURKBAURKAKDRPARP1DHODH | |
| SCHEMBL6809857 | 0.88 | AURKB (0.70) | AURKBAURKAKDRPARP1DHODH | |
| SCHEMBL6801539 | 0.88 | AURKB (0.45) | AURKBAURKAKDRPARP1CHEK2 | |
| SCHEMBL6800819 | 0.88 | PARP1 (0.46) | AURKBAURKAKDRPARP1DHODH | |
| SCHEMBL6801867 | 0.86 | AURKB (0.67) | AURKBAURKAKDRPARP1DHODH | |
| SCHEMBL6800061 | 0.85 | PARP1 (0.41) | AURKBAURKAKDRPARP1CHEK2 |
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-6696437-B1 | Heterocyclically substituted benzimidazoles, the production and application thereof | ABBOTT GMBH & CO. KG (DE) | 2004-02-24 | — | — | US | disclosed |