Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 2/20 | 0.35 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | HEXA | P06865 | 1/20 | 0.31 |
| ▸ | HEXB | P07686 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | DRD3 | P35462 | 1/20 | 0.30 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | MAOB | P27338 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4808073 | 0.89 | DYRK1A (0.39) | DYRK1AGAAHEXAHEXBMAOA | |
| SCHEMBL4064490 | 0.83 | GLP1R (0.34) | HEXAHEXBDRD2DRD3MAOA | |
| SCHEMBL4749400 | 0.83 | MAOA (0.35) | GAADRD2DRD3MAOAMAOB | |
| Hydrochloric Acid SCHEMBL4250086 | 0.82 | MAOA (0.35) | GAADRD2DRD3MAOAMAOB | |
| SCHEMBL4749114 | 0.78 | HRH4 (0.33) | GAADRD2DRD3 | |
| SCHEMBL4072001 | 0.78 | BACE1 (0.40) | NOS3NOS1NOS2GAABACE1 | |
| SCHEMBL4746125 | 0.77 | KDM4E (0.42) | GAA | |
| SCHEMBL4746139 | 0.77 | ATM (0.34) | GAA | |
| SCHEMBL4245511 | 0.76 | MAPT (0.32) | — | |
| SCHEMBL4749246 | 0.74 | DYRK1A (0.36) | DYRK1ANOS3NOS1NOS2GAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008123756-A1 | A PHARMACEUTICAL COMPOSITIONS CONTAINING LACTON TYPE PYRIDINE DERIVATIVES AS AN EFFECTIVE INGREDIENT FOR THE PREVENTION AND TREATMENT OF ISCHEMIA | SK CHEMICALS CO., LTD. (KR) | 2008-10-16 | — | — | WO | claimed |