Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 10/20 | 0.55 |
| ▸ | SLC6A4 | P31645 | 10/20 | 0.55 |
| ▸ | SLC6A3 | Q01959 | 10/20 | 0.55 |
| ▸ | UGT2B7 | P16662 | 1/20 | 0.50 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3673974 | 0.83 | UGT2B7 (0.56) | SLC6A2SLC6A4SLC6A3UGT2B7AOC3 | |
| SCHEMBL5231024 | 0.82 | UGT2B7 (0.53) | SLC6A2SLC6A4SLC6A3UGT2B7AOC3 | |
| SCHEMBL8102026 | 0.80 | TSHR (0.50) | SLC6A2SLC6A4SLC6A3AOC3TSHR | |
| SCHEMBL3663686 | 0.78 | SLC6A2 (0.54) | SLC6A2SLC6A4SLC6A3UGT2B7MEN1 | |
| SCHEMBL11547167 | 0.77 | UGT2B7 (0.47) | SLC6A2SLC6A4SLC6A3UGT2B7AOC3 | |
| SCHEMBL27469529 | 0.77 | UGT2B7 (0.61) | SLC6A2SLC6A4SLC6A3UGT2B7AOC3 | |
| SCHEMBL17455348 | 0.76 | SLC6A2 (0.56) | SLC6A2SLC6A4SLC6A3UGT2B7AOC3 | |
| SCHEMBL3041531 | 0.74 | TSHR (0.57) | SLC6A2SLC6A4SLC6A3UGT2B7AOC3 | |
| SCHEMBL27536762 | 0.74 | TSHR (0.57) | SLC6A2SLC6A4SLC6A3UGT2B7AOC3 | |
| SCHEMBL12004836 | 0.74 | SLC6A2 (0.45) | SLC6A2SLC6A4SLC6A3UGT2B7MEN1 |
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-6069177-A | ADMINISTERING TO THE HUMAN AN EFFECTIVE ANTIDEPRESSANT DOSE OF THE COMPOUND 3-HYDROXY-4,4-DIMETHYL-2-(2'-NAPHTHYL)PENTYL-N,N-DIMETHYLAMINE OR SALT | THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (HK) | 2000-05-30 | — | — | US | disclosed |