Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
| ▸ | IDO1 | P14902 | 2/20 | 0.45 |
| ▸ | DPP4 | P27487 | 11/20 | 0.44 |
| ▸ | DPP7 | Q9UHL4 | 3/20 | 0.44 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | DPP8 | Q6V1X1 | 2/20 | 0.39 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4674867 | 1.00 | TAAR1 (0.54) | TAAR1CYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL7235535 | 0.85 | DPP4 (0.45) | TAAR1CYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL5225287 | 0.82 | DPP4 (0.47) | TAAR1CYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL7214170 | 0.82 | TAAR1 (0.47) | TAAR1CYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL7955916 | 0.82 | DPP4 (0.47) | TAAR1CYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL3131950 | 0.82 | DPP4 (0.47) | TAAR1CYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL3674139 | 0.80 | TAAR1 (0.54) | TAAR1CYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL13995122 | 0.79 | AOC3 (0.44) | TAAR1CYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL1467599 | 0.78 | TAAR1 (0.52) | TAAR1CYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL978947 | 0.77 | DPP4 (0.57) | DPP4DPP7DPP8DPP9 |
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-1314732-A2 | Substituted pyrimidine compounds and their use | AMGEN INC. (US) | 2003-05-28 | — | — | EP | disclosed |