Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 5/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.41 |
| ▸ | AKT1 | P31749 | 4/20 | 0.39 |
| ▸ | CHUK | O15111 | 2/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.39 |
| ▸ | PIM1 | P11309 | 2/20 | 0.39 |
| ▸ | PRKACA | P17612 | 2/20 | 0.39 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.39 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.39 |
| ▸ | CLK2 | P49760 | 1/20 | 0.39 |
| ▸ | PRKX | P51817 | 1/20 | 0.39 |
| ▸ | PRKG2 | Q13237 | 1/20 | 0.39 |
| ▸ | PRKG1 | Q13976 | 1/20 | 0.39 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.39 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 3/20 | 0.37 |
| ▸ | CHRNA3 | P32297 | 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 | |
|---|---|---|---|---|
| SCHEMBL5196862 | 1.00 | CHRNB2 (0.41) | CHRNB2CHRNA4AKT1CHUKROCK2 | |
| SCHEMBL617831 | 0.81 | CHRNB2 (0.65) | CHRNB2CHRNA4AKT1CHUKROCK2 | |
| SCHEMBL619853 | 0.81 | CHRNB2 (0.65) | CHRNB2CHRNA4AKT1CHUKROCK2 | |
| SCHEMBL617830 | 0.81 | CHRNB2 (0.65) | CHRNB2CHRNA4AKT1CHUKROCK2 | |
| SCHEMBL5198043 | 0.81 | CHRNB2 (0.65) | CHRNB2CHRNA4AKT1CHUKROCK2 | |
| SCHEMBL5198055 | 0.81 | CHRNB2 (0.65) | CHRNB2CHRNA4AKT1CHUKROCK2 | |
| SCHEMBL619852 | 0.81 | CHRNB2 (0.65) | CHRNB2CHRNA4AKT1CHUKROCK2 | |
| SCHEMBL7099700 | 0.80 | CHRNB2 (0.66) | CHRNB2CHRNA4AKT1CHUKROCK2 | |
| SCHEMBL3960211 | 0.80 | ROCK2 (0.50) | CHRNB2CHRNA4AKT1CHUKROCK2 | |
| SCHEMBL365733 | 0.80 | ROCK2 (0.50) | CHRNB2CHRNA4AKT1CHUKROCK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1814852-A2 | HYDROXYBENZOATE SALTS OF METANICOTINE COMPOUNDS | Targacept, Inc. (US) | 2007-08-08 | — | — | EP | disclosed |
| WO-2006053082-A2 | HYDROXYBENZOATE SALTS OF METANICOTINE COMPOUNDS | TARGACEPT, INC. (US) | 2006-05-18 | — | — | WO | disclosed |