Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 12/20 | 0.51 |
| ▸ | SLC6A2 | P23975 | 10/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 10/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.31 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6454483 | 1.00 | SLC6A4 (0.51) | SLC6A4SLC6A2SLC6A3CYP1A2CYP2A6 | |
| SCHEMBL6452518 | 0.93 | SLC6A4 (0.53) | SLC6A4SLC6A2SLC6A3CYP1A2CYP2A6 | |
| SCHEMBL6452511 | 0.93 | SLC6A4 (0.53) | SLC6A4SLC6A2SLC6A3CYP1A2CYP2A6 | |
| SCHEMBL6452666 | 0.88 | SLC6A4 (0.39) | SLC6A4SLC6A2SLC6A3ESR2DRD2 | |
| SCHEMBL6452670 | 0.88 | SLC6A4 (0.39) | SLC6A4SLC6A2SLC6A3ESR2DRD2 | |
| SCHEMBL14228618 | 0.84 | ESR2 (0.43) | SLC6A4SLC6A2SLC6A3ESR2HRH3 | |
| SCHEMBL6459394 | 0.83 | SLC6A4 (0.39) | SLC6A4SLC6A2SLC6A3HTR1A | |
| SCHEMBL6459396 | 0.83 | SLC6A4 (0.39) | SLC6A4SLC6A2SLC6A3HTR1A | |
| SCHEMBL6452214 | 0.82 | SLC6A2 (0.36) | SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL6452210 | 0.82 | SLC6A2 (0.36) | SLC6A4SLC6A2SLC6A3 |
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-6913797-B1 | Decahydronaphthalene derivative | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2005-07-05 | — | — | US | disclosed |
| EP-1108700-A1 | DECAHYDRONAPHTHALENE DERIVATIVE | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2001-06-20 | — | — | EP | disclosed |