Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 6/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.35 |
| ▸ | MITF | O75030 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15062243 | 0.83 | SLC18A2 (0.51) | SLC6A4SLC6A2SLC6A3CYP2D6SLC18A2 | |
| SCHEMBL10585714 | 0.80 | SLC18A2 (0.48) | SLC18A2 | |
| SCHEMBL20247261 | 0.75 | SIGMAR1 (0.53) | SLC6A4SLC6A2SLC6A3TAAR1 | |
| SCHEMBL22285003 | 0.71 | SLC6A2 (0.65) | SLC6A4SLC6A2SLC6A3CYP2D6MITF | |
| SCHEMBL10413244 | 0.71 | SLC6A2 (0.65) | SLC6A4SLC6A2SLC6A3CYP2D6MITF | |
| SCHEMBL6926417 | 0.71 | SLC6A2 (0.65) | SLC6A4SLC6A2SLC6A3CYP2D6MITF | |
| SCHEMBL10585704 | 0.70 | SLC18A2 (0.43) | SLC6A4SLC18A2 | |
| SCHEMBL27931666 | 0.70 | GBA1 (0.46) | SLC6A4 | |
| SCHEMBL20247217 | 0.68 | TAAR1 (0.42) | SLC6A4SLC6A2SLC6A3CYP2D6MITF | |
| SCHEMBL13518011 | 0.68 | TAAR1 (0.41) | SLC6A4SLC6A2SLC6A3SLC18A2TAAR1 |
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-1075467-A1 | PYRAZOLE DERIVATIVES AS P-38 MAP KINASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2001-02-14 | — | — | EP | disclosed |
| WO-1999057101-A1 | PYRAZOLE DERIVATIVES AS P-38 MAP KINASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 1999-11-11 | — | — | WO | disclosed |