Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 3/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2359508 | 0.73 | POLB (0.35) | ALDH1A1CYP3A4CYP2C19CYP2C9POLB | |
| SCHEMBL1188768 | 0.73 | POLB (0.41) | ALDH1A1CYP3A4CYP2C19CYP2C9POLB | |
| SCHEMBL28735789 | 0.72 | SLC6A2 (0.39) | SLC6A2SLC6A3SLC6A4ALDH1A1 | |
| SCHEMBL809556 | 0.72 | CYP2D6 (0.38) | ALDH1A1CYP3A4CYP2C19CYP2C9POLB | |
| SCHEMBL22387461 | 0.70 | POLB (0.37) | ALDH1A1CYP3A4CYP2C19CYP2C9POLB | |
| SCHEMBL22270967 | 0.70 | POLB (0.37) | ALDH1A1CYP3A4CYP2C19CYP2C9POLB | |
| SCHEMBL22270906 | 0.70 | POLB (0.37) | ALDH1A1CYP3A4CYP2C19CYP2C9POLB | |
| SCHEMBL22387388 | 0.69 | ALDH1A1 (0.32) | ALDH1A1CYP3A4CYP2C19CYP2C9POLB | |
| SCHEMBL27767565 | 0.69 | SLC6A3 (0.58) | SLC6A2SLC6A3SLC6A4ALDH1A1 | |
| SCHEMBL30609143 | 0.68 | SLC6A3 (0.57) | SLC6A2SLC6A3SLC6A4ALDH1A1 |
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-2352730-A2 | BIOLOGICALLY ACTIVE AMIDES | H. Lundbeck A/S (DK) | 2011-08-10 | — | — | EP | disclosed |
| WO-2010053861-A2 | BIOLOGICALLY ACTIVE AMIDES | H. LUNDBECK A/S (DK) | 2010-05-14 | — | — | WO | disclosed |