Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 19/20 | 0.55 |
| ▸ | SLC6A4 | P31645 | 19/20 | 0.55 |
| ▸ | SLC6A3 | Q01959 | 7/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.52 |
| ▸ | NOS3 | P29474 | 1/20 | 0.46 |
| ▸ | NOS1 | P29475 | 1/20 | 0.46 |
| ▸ | NOS2 | P35228 | 1/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5995158 | 0.95 | SLC6A2 (0.60) | SLC6A2SLC6A4SLC6A3CYP2D6KCNH2 | |
| Fumaric Acid SCHEMBL5994708 | 0.92 | SLC6A2 (0.63) | SLC6A2SLC6A4SLC6A3CYP2D6KCNH2 | |
| Fumaric Acid SCHEMBL5994703 | 0.92 | SLC6A2 (0.63) | SLC6A2SLC6A4SLC6A3CYP2D6KCNH2 | |
| Fumaric Acid SCHEMBL5997415 | 0.87 | SLC6A2 (0.68) | SLC6A2SLC6A4SLC6A3CYP2D6KCNH2 | |
| Fumaric Acid SCHEMBL5997405 | 0.87 | SLC6A2 (0.68) | SLC6A2SLC6A4SLC6A3CYP2D6KCNH2 | |
| SCHEMBL5996559 | 0.81 | SLC6A2 (0.63) | SLC6A2SLC6A4SLC6A3CYP2D6HTR1A | |
| SCHEMBL5996805 | 0.81 | SLC6A2 (0.76) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL5997531 | 0.81 | SLC6A2 (0.57) | SLC6A2SLC6A4SLC6A3CYP2D6KCNH2 | |
| SCHEMBL5996323 | 0.80 | SLC6A2 (0.55) | SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL5993834 | 0.79 | SLC6A2 (0.59) | SLC6A2SLC6A4SLC6A3CYP2D6NOS3 |
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 |