Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 17/20 | 0.61 |
| ▸ | SLC6A4 | P31645 | 17/20 | 0.61 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.61 |
| ▸ | NOS2 | P35228 | 3/20 | 0.56 |
| ▸ | NOS3 | P29474 | 2/20 | 0.53 |
| ▸ | NOS1 | P29475 | 2/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL5995407 | 0.93 | SLC6A2 (0.64) | SLC6A2SLC6A4SLC6A3NOS2NOS3 | |
| SCHEMBL5995944 | 0.90 | SLC6A2 (0.63) | SLC6A2SLC6A4SLC6A3NOS2NOS3 | |
| SCHEMBL5994236 | 0.87 | NOS2 (0.71) | SLC6A2SLC6A4SLC6A3NOS2NOS3 | |
| SCHEMBL5993861 | 0.86 | SLC6A2 (0.64) | SLC6A2SLC6A4SLC6A3NOS2NOS3 | |
| Cadaverine Tartrate SCHEMBL5996582 | 0.86 | SLC6A4 (0.68) | SLC6A2SLC6A4SLC6A3CYP2D6KCNH2 | |
| SCHEMBL5997358 | 0.85 | SLC6A2 (0.71) | SLC6A2SLC6A4SLC6A3NOS2NOS3 | |
| SCHEMBL5996210 | 0.84 | SLC6A2 (0.67) | SLC6A2SLC6A4SLC6A3NOS2NOS3 | |
| SCHEMBL4482093 | 0.83 | SLC6A2 (0.66) | SLC6A2SLC6A4SLC6A3NOS2NOS3 | |
| Cadaverine Tartrate SCHEMBL5997403 | 0.83 | SLC6A4 (0.65) | SLC6A2SLC6A4SLC6A3NOS2CYP2D6 | |
| SCHEMBL5998602 | 0.82 | SLC6A2 (0.65) | SLC6A2SLC6A4SLC6A3NOS2NOS3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1569905-A2 | INHIBITORS OF MONOAMINE UPTAKE | ELI LILLY AND COMPANY (US) | 2005-09-07 | — | — | EP | disclosed |
| WO-2004052858-A2 | INHIBITORS OF MONOAMINE UPTAKE | ELI LILLY AND COMPANY (US) | 2004-06-24 | — | — | WO | disclosed |