Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA3 | P32297 | 5/20 | 0.37 |
| ▸ | CHRNB1 | P11230 | 4/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 4/20 | 0.37 |
| ▸ | CHRNB4 | P30926 | 4/20 | 0.37 |
| ▸ | CHRNB3 | Q05901 | 4/20 | 0.37 |
| ▸ | AKT1 | P31749 | 5/20 | 0.35 |
| ▸ | CHUK | O15111 | 1/20 | 0.32 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.32 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.32 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.32 |
| ▸ | PIM1 | P11309 | 1/20 | 0.32 |
| ▸ | PRKACA | P17612 | 1/20 | 0.32 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.32 |
| ▸ | CLK2 | P49760 | 1/20 | 0.32 |
| ▸ | PRKX | P51817 | 1/20 | 0.32 |
| ▸ | PRKG2 | Q13237 | 1/20 | 0.32 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.32 |
| ▸ | PRKG1 | Q13976 | 1/20 | 0.32 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6102061 | 0.94 | CHRNB1 (0.36) | CHRNA3CHRNB1CHRNB2CHRNB4CHRNB3 | |
| SCHEMBL6102057 | 0.94 | CHRNB1 (0.36) | CHRNA3CHRNB1CHRNB2CHRNB4CHRNB3 | |
| SCHEMBL1645371 | 0.86 | CHRNB2 (0.39) | CHRNA3CHRNB1CHRNB2CHRNB4CHRNB3 | |
| SCHEMBL6225866 | 0.86 | CHRNB1 (0.44) | CHRNA3CHRNB1CHRNB2CHRNB4CHRNB3 | |
| SCHEMBL2214137 | 0.83 | AKT1 (0.42) | CHRNA3CHRNB1CHRNB2CHRNB4CHRNB3 | |
| SCHEMBL2214139 | 0.83 | AKT1 (0.42) | CHRNA3CHRNB1CHRNB2CHRNB4CHRNB3 | |
| SCHEMBL2214142 | 0.83 | AKT1 (0.42) | CHRNA3CHRNB1CHRNB2CHRNB4CHRNB3 | |
| SCHEMBL1349334 | 0.80 | CHRNB2 (0.49) | CHRNA3CHRNB1CHRNB2CHRNB4CHRNB3 | |
| SCHEMBL1349331 | 0.80 | CHRNB2 (0.49) | CHRNA3CHRNB1CHRNB2CHRNB4CHRNB3 | |
| SCHEMBL1349085 | 0.78 | AKT1 (0.50) | CHRNA3CHRNB1CHRNB2CHRNB4CHRNB3 |
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-2008157365-A2 | VINYLAZACYCLOALKANES FOR TREATING NEUROPATHIC PAIN | TARGACEPT, INC. (US) | 2008-12-24 | — | — | WO | disclosed |