Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 5/20 | 0.60 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | BCHE | P06276 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL11354054 | 0.85 | CYP2D6 (0.62) | SLC6A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL16113966 | 0.83 | CYP2D6 (0.60) | SLC6A4CYP2D6TAAR1 | |
| SCHEMBL5830749 | 0.83 | BCHE (0.61) | SLC6A4SLC18A2SLC6A2BCHE | |
| SCHEMBL10946975 | 0.77 | SLC6A4 (0.56) | SLC6A4 | |
| SCHEMBL19265565 | 0.77 | SLC6A4 (0.55) | SLC6A4SLC6A2CYP2D6TAAR1 | |
| SCHEMBL1475594 | 0.77 | SLC6A4 (0.55) | SLC6A4SLC6A2TAAR1 | |
| SCHEMBL3086360 | 0.77 | SLC6A4 (0.55) | SLC6A4SLC6A2CYP2D6TAAR1 | |
| SCHEMBL1581866 | 0.76 | ACHE (0.62) | SLC6A4SLC6A2 | |
| Hydrochloric Acid SCHEMBL1475501 | 0.75 | SLC6A4 (0.54) | SLC6A4SLC6A2TAAR1 | |
| SCHEMBL5781113 | 0.75 | GBA1 (0.56) | SLC6A4 |
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-6265434-B1 | ANTIINFLAMMATORY AGENTS | MERCK & CO., INC. | 2001-07-24 | — | — | US | disclosed |