Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 2/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 9/20 | 0.49 |
| ▸ | DRD4 | P21917 | 2/20 | 0.47 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7621718 | 0.94 | HRH3 (0.53) | HRH3DRD4ALDH3A1ALDH1A1KCNH2 | |
| SCHEMBL10384122 | 0.94 | HRH3 (0.53) | HRH3DRD4ALDH3A1ALDH1A1KCNH2 | |
| SCHEMBL7390013 | 0.94 | HRH3 (0.53) | HRH3DRD4ALDH3A1ALDH1A1KCNH2 | |
| SCHEMBL6752147 | 0.94 | HRH3 (0.53) | HRH3DRD4ALDH3A1ALDH1A1KCNH2 | |
| SCHEMBL10732157 | 0.92 | LTA4H (0.53) | LTA4HPTGS2HRH3DRD4ALDH3A1 | |
| SCHEMBL1172364 | 0.92 | DRD4 (0.53) | HRH3DRD4ALDH3A1ALDH1A1KCNH2 | |
| SCHEMBL17233002 | 0.89 | HRH3 (0.49) | HRH3DRD4ALDH3A1ALDH1A1KCNH2 | |
| SCHEMBL4754349 | 0.86 | DRD4 (0.55) | HRH3DRD4ALDH3A1ALDH1A1KCNH2 | |
| SCHEMBL4743108 | 0.84 | ALDH3A1 (0.47) | HRH3DRD4ALDH3A1ALDH1A1KCNH2 | |
| SCHEMBL11567216 | 0.84 | ALDH3A1 (0.47) | HRH3DRD4ALDH3A1ALDH1A1KCNH2 |
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-2008107320-A1 | PIPERIDINE AND PIPERAZINE DERIVATIVES USED AS ANTI-NEOPLASIC AGENTS OR CELL PROLIFERATION INHIBITORS | CEREP (FR) | 2008-09-12 | — | — | WO | disclosed |