Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB4 | P30926 | 2/20 | 0.51 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.51 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.43 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.43 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | GHSR | Q92847 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11449118 | 0.96 | CHRNB4 (0.47) | CHRNB4CHRNA3CHRNB2CHRNA4PIM1 | |
| SCHEMBL11456174 | 0.82 | CHRNB4 (0.74) | CHRNB4CHRNA3CHRNB2CHRNA4PIM1 | |
| SCHEMBL11447454 | 0.82 | CHEK2 (0.46) | — | |
| SCHEMBL11448591 | 0.80 | CHRNB4 (0.50) | CHRNB4CHRNA3CYP3A4GHSR | |
| SCHEMBL6055037 | 0.80 | MEN1 (0.53) | CHRNB4CHRNA3CHRNB2CHRNA4HSP90AA1 | |
| SCHEMBL11466924 | 0.80 | CHRNB4 (0.50) | CHRNB4CHRNA3CHRNB2CHRNA4MKNK1 | |
| SCHEMBL11466925 | 0.80 | CHRNB4 (0.54) | CHRNB4CHRNA3CHRNB2CHRNA4MKNK1 | |
| SCHEMBL11449105 | 0.79 | CHRNB4 (0.68) | CHRNB4CHRNA3CHRNB2CHRNA4PIM1 | |
| SCHEMBL11466687 | 0.78 | CHEK2 (0.50) | — | |
| SCHEMBL11455983 | 0.77 | CHRNB4 (0.51) | CHRNB4CHRNA3CHRNB2CHRNA4MKNK1 |
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-4225608-A | ANTIDEPRESSANTS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1980-09-30 | — | — | US | disclosed |