Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 16/20 | 0.58 |
| ▸ | AURKB | Q96GD4 | 4/20 | 0.58 |
| ▸ | AURKA | O14965 | 3/20 | 0.58 |
| ▸ | DHODH | Q02127 | 2/20 | 0.55 |
| ▸ | KDR | P35968 | 2/20 | 0.49 |
| ▸ | PARP2 | Q9UGN5 | 4/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL6806881 | 0.97 | AURKB (0.61) | PARP1AURKBAURKADHODHKDR | |
| SCHEMBL6800047 | 0.95 | PARP1 (0.56) | PARP1AURKBAURKADHODHKDR | |
| SCHEMBL6806228 | 0.92 | AURKB (0.58) | PARP1AURKBAURKADHODHKDR | |
| SCHEMBL6810671 | 0.90 | AURKB (0.63) | PARP1AURKBAURKADHODHKDR | |
| SCHEMBL6806488 | 0.90 | PARP1 (0.61) | PARP1AURKBAURKADHODHKDR | |
| SCHEMBL6805128 | 0.89 | AURKB (0.66) | PARP1AURKBAURKADHODHKDR | |
| SCHEMBL6587662 | 0.89 | PARP1 (0.46) | PARP1AURKBAURKADHODHKDR | |
| SCHEMBL6805815 | 0.88 | AURKB (0.43) | PARP1AURKBAURKADHODHKDR | |
| SCHEMBL6806358 | 0.87 | AURKB (0.65) | PARP1AURKBAURKADHODHKDR | |
| SCHEMBL6806072 | 0.86 | AURKB (0.68) | PARP1AURKBAURKADHODHKDR |
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 |