Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 13/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 8/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 8/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4306728 | 0.83 | SLC6A4 (0.65) | SLC6A4SLC6A2SLC6A3HRH3KDM4E | |
| SCHEMBL17044151 | 0.82 | SLC6A2 (0.44) | SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL17044156 | 0.80 | SLC6A4 (0.48) | SLC6A4SLC6A2SLC6A3HRH3CYP2D6 | |
| SCHEMBL4305917 | 0.80 | SLC6A4 (0.63) | SLC6A4SLC6A2SLC6A3HRH3CYP2D6 | |
| SCHEMBL4305174 | 0.78 | SLC6A4 (0.44) | SLC6A4SLC6A2SLC6A3HRH3CYP2D6 | |
| SCHEMBL4307044 | 0.76 | SLC6A4 (0.43) | SLC6A4SLC6A2SLC6A3HRH3CYP2D6 | |
| SCHEMBL17044152 | 0.76 | SLC6A4 (0.58) | SLC6A4SLC6A2SLC6A3HRH3CYP2D6 | |
| SCHEMBL4309427 | 0.75 | SLC6A2 (0.61) | SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL4310233 | 0.75 | SLC6A2 (0.57) | SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL4309253 | 0.74 | SLC6A4 (0.63) | SLC6A4SLC6A2SLC6A3HRH3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1778639-B1 | ARYL-AND HETEROARYL-SUBSTITUTED TETRAHYDROISOQUINOLINES AND USE THEREOF TO BLOCK REUPTAKE OF NOREPINEPHRINE, DOPAMINE, AND SEROTONIN | ALBANY MOLECULAR RES INC (US) | 2015-09-02 | — | — | EP | disclosed |