Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.53 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.53 |
| ▸ | AOC3 | Q16853 | 3/20 | 0.42 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.36 |
| ▸ | SLC6A9 | P48067 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.35 |
| ▸ | FDPS | P14324 | 1/20 | 0.33 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | TDO2 | P48775 | 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 | |
|---|---|---|---|---|
| SCHEMBL3404257 | 0.92 | SLC6A2 (0.46) | SLC6A2SLC6A4SLC6A3AOC3PIK3CD | |
| SCHEMBL3404255 | 0.83 | SLC6A2 (0.40) | SLC6A2SLC6A4SLC6A3AOC3ALDH1A1 | |
| SCHEMBL4066408 | 0.81 | SLC6A2 (0.44) | SLC6A2SLC6A4SLC6A3AOC3SLC6A9 | |
| SCHEMBL4067931 | 0.79 | CFD (0.49) | SLC6A2SLC6A4SLC6A3AOC3 | |
| SCHEMBL4578371 | 0.75 | AOC3 (0.44) | SLC6A2SLC6A4SLC6A3AOC3CYP2D6 | |
| SCHEMBL2415110 | 0.75 | AOC3 (0.44) | SLC6A2SLC6A4SLC6A3AOC3CYP2D6 | |
| SCHEMBL16334289 | 0.75 | AOC3 (0.44) | SLC6A2SLC6A4SLC6A3AOC3CYP2D6 | |
| Hydrochloric Acid SCHEMBL27833791 | 0.73 | IDO1 (0.45) | SLC6A2SLC6A4SLC6A3AOC3CYP2D6 | |
| Hydrochloric Acid SCHEMBL27833790 | 0.73 | IDO1 (0.45) | SLC6A2SLC6A4SLC6A3AOC3CYP2D6 | |
| SCHEMBL14566198 | 0.72 | SLC6A2 (0.58) | SLC6A2SLC6A4SLC6A3AOC3ALDH1A1 |
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-1686999-B1 | PYRAZOLE DERIVATIVES AS INHIBITORS OF RECEPTOR TYROSINE KINASES | ASTRAZENECA AB (SE) | 2009-07-01 | — | — | EP | disclosed |