Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 3/20 | 0.72 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.72 |
| ▸ | KDR | P35968 | 1/20 | 0.52 |
| ▸ | PARP1 | P09874 | 10/20 | 0.44 |
| ▸ | DHODH | Q02127 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 2/20 | 0.40 |
| ▸ | DRD3 | P35462 | 2/20 | 0.40 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | HTR7 | P34969 | 2/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL6802572 | 0.95 | AURKA (0.64) | AURKAAURKBKDRPARP1DHODH | |
| SCHEMBL6806887 | 0.92 | AURKA (0.60) | AURKAAURKBKDRPARP1DHODH | |
| SCHEMBL6810471 | 0.91 | AURKA (0.68) | AURKAAURKBKDRPARP1DHODH | |
| SCHEMBL6805101 | 0.89 | AURKA (0.64) | AURKAAURKBKDRPARP1DHODH | |
| SCHEMBL3582854 | 0.88 | AURKB (0.70) | AURKAAURKBKDRPARP1DHODH | |
| SCHEMBL6806130 | 0.88 | AURKA (0.56) | AURKAAURKBKDRPARP1DGAT1 | |
| SCHEMBL6804561 | 0.87 | AURKB (0.93) | AURKAAURKBKDRPARP1DHODH | |
| SCHEMBL6806441 | 0.86 | AURKB (0.70) | AURKAAURKBKDRPARP1DHODH | |
| SCHEMBL6805914 | 0.86 | AURKA (0.55) | AURKAAURKBKDRPARP1DHODH | |
| SCHEMBL6806351 | 0.86 | AURKA (0.59) | AURKAAURKBKDRPARP1DGAT1 |
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 |