Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 2/20 | 0.69 |
| ▸ | TBK1 | Q9UHD2 | 14/20 | 0.58 |
| ▸ | IKBKE | Q14164 | 13/20 | 0.58 |
| ▸ | AURKB | Q96GD4 | 8/20 | 0.58 |
| ▸ | CDK2 | P24941 | 1/20 | 0.57 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.48 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.48 |
| ▸ | USP30 | Q70CQ3 | 3/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL4058688 | 0.89 | AURKA (0.58) | AURKATBK1IKBKEAURKBCDK2 | |
| SCHEMBL4059854 | 0.85 | AURKA (0.51) | AURKATBK1IKBKEAURKBCDK2 | |
| SCHEMBL4053814 | 0.85 | USP30 (0.51) | AURKATBK1USP30 | |
| SCHEMBL4056950 | 0.83 | GRIN1 (0.52) | AURKATBK1IKBKEAURKBCDK2 | |
| SCHEMBL4061801 | 0.82 | PDE5A (0.54) | AURKATBK1IKBKEAURKBUSP30 | |
| SCHEMBL13607937 | 0.81 | GRIN1 (0.53) | AURKAGRIN1GRIN2B | |
| SCHEMBL4052372 | 0.81 | AURKA (0.69) | AURKATBK1IKBKEAURKBCDK2 | |
| SCHEMBL4055992 | 0.80 | AURKA (0.68) | AURKATBK1IKBKEAURKBCDK2 | |
| SCHEMBL4061926 | 0.78 | GUSB (0.48) | AURKAUSP30 | |
| SCHEMBL4053079 | 0.77 | AURKA (0.67) | AURKATBK1IKBKEAURKBCDK2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7622479-B2 | Bicyclic derivative, its production and use | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-11-24 | — | — | US | disclosed |
| EP-1460067-A1 | BICYCLIC DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE | Takeda Chemical Industries, Ltd. (JP) | 2004-09-22 | — | — | EP | disclosed |