Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 8/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 7/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 7/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.30 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.30 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.30 |
| ▸ | OPRL1 | P41146 | 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 | |
|---|---|---|---|---|
| SCHEMBL7911060 | 1.00 | CYP2C9 (0.34) | CYP2C9SLC6A4SLC6A2SLC6A3ALDH1A1 | |
| SCHEMBL6452429 | 0.94 | SLC6A4 (0.33) | CYP2C9SLC6A4SLC6A2SLC6A3MAPT | |
| SCHEMBL6452425 | 0.94 | SLC6A4 (0.33) | CYP2C9SLC6A4SLC6A2SLC6A3MAPT | |
| SCHEMBL6463303 | 0.93 | SLC6A4 (0.32) | SLC6A4SLC6A2SLC6A3MAPTKDM1A | |
| SCHEMBL6463305 | 0.93 | SLC6A4 (0.32) | SLC6A4SLC6A2SLC6A3MAPTKDM1A | |
| SCHEMBL7920015 | 0.92 | GAA (0.33) | SLC6A4SLC6A2SLC6A3MAPTKDM1A | |
| SCHEMBL6460013 | 0.92 | GAA (0.33) | SLC6A4SLC6A2SLC6A3MAPTKDM1A | |
| SCHEMBL6460019 | 0.92 | GAA (0.33) | SLC6A4SLC6A2SLC6A3MAPTKDM1A | |
| SCHEMBL7920014 | 0.92 | GAA (0.33) | SLC6A4SLC6A2SLC6A3MAPTKDM1A | |
| SCHEMBL6452462 | 0.91 | SLC6A4 (0.37) | SLC6A4SLC6A2SLC6A3KDM1ADRD2 |
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-1108700-A1 | DECAHYDRONAPHTHALENE DERIVATIVE | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2001-06-20 | — | — | EP | disclosed |