Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 7/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.40 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7290560 | 0.82 | MEN1 (0.44) | SLC6A2SLC6A4SLC6A3SLC6A9SLC6A5 | |
| SCHEMBL11083984 | 0.82 | SLC6A9 (0.48) | SLC6A2SLC6A4SLC6A3SLC6A9SLC6A5 | |
| SCHEMBL7280392 | 0.81 | SLC6A2 (0.41) | SLC6A2SLC6A4SLC6A3CHRM4CYP3A4 | |
| SCHEMBL11077996 | 0.80 | SLC6A9 (0.45) | SLC6A9SLC6A5 | |
| SCHEMBL7280201 | 0.80 | SMN1; SMN2 (0.47) | — | |
| SCHEMBL11083674 | 0.75 | KMT2A (0.48) | SLC6A9SLC6A5 | |
| SCHEMBL7286509 | 0.74 | KDM4E (0.47) | SLC6A9SLC6A5 | |
| SCHEMBL7287247 | 0.73 | SLC6A9 (0.49) | SLC6A2SLC6A4SLC6A3SLC6A9SLC6A5 | |
| SCHEMBL1286420 | 0.73 | SLC6A9 (0.46) | SLC6A9SLC6A5 | |
| SCHEMBL7286178 | 0.72 | MEN1 (0.46) | SLC6A2SLC6A4SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| US-4440941-A | Aroyl-aminoacids, amides and esters thereof | USV PHARMACEUTICAL CORPORATION (US) | 1984-04-03 | — | — | US | disclosed |
| EP-0054936-A1 | Aroyl amino acids | USV PHARMACEUTICAL CORPORATION (US) | 1982-06-30 | — | — | EP | disclosed |