Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKB | Q96GD4 | 4/20 | 0.51 |
| ▸ | AURKA | O14965 | 3/20 | 0.51 |
| ▸ | KDR | P35968 | 2/20 | 0.51 |
| ▸ | PARP1 | P09874 | 11/20 | 0.47 |
| ▸ | DHODH | Q02127 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | CHEK2 | O96017 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6583764 | 0.98 | AURKB (0.53) | AURKBAURKAKDRPARP1DHODH | |
| SCHEMBL6587813 | 0.96 | AURKB (0.52) | AURKBAURKAKDRPARP1DHODH | |
| SCHEMBL6588575 | 0.93 | AURKB (0.54) | AURKBAURKAKDRPARP1DHODH | |
| SCHEMBL6586442 | 0.91 | AURKB (0.49) | AURKBAURKAKDRPARP1DHODH | |
| SCHEMBL6590927 | 0.91 | AURKB (0.47) | AURKBAURKAKDRPARP1DHODH | |
| SCHEMBL6806358 | 0.89 | AURKB (0.65) | AURKBAURKAKDRPARP1DHODH | |
| SCHEMBL6588091 | 0.89 | AURKB (0.51) | AURKBAURKAKDRPARP1DHODH | |
| SCHEMBL6587662 | 0.88 | PARP1 (0.46) | AURKBAURKAKDRPARP1DHODH | |
| SCHEMBL6587284 | 0.87 | AURKB (0.47) | AURKBAURKAKDRPARP1DHODH | |
| SCHEMBL7538951 | 0.87 | PARP1 (0.47) | AURKBAURKAKDRPARP1DHODH |
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 |
|---|---|---|---|---|---|---|---|
| EP-1177178-B1 | HETEROCYCLICALLY SUBSTITUTED BENZIMIDAZOLES, THE PRODUCTION AND APPLICATION THEREOF | ABBOTT GMBH & CO KG (DE) | 2004-12-29 | — | — | EP | disclosed |