Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 3/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 4/20 | 0.33 |
| ▸ | PTGES | O14684 | 1/20 | 0.33 |
| ▸ | G6PC1 | P35575 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL8323030 | 0.81 | SLC6A2 (0.44) | SLC6A2TAAR1SLC6A4SLC6A3HTR2A | |
| SCHEMBL8321757 | 0.79 | SLC6A2 (0.48) | SLC6A2TAAR1TRPA1KIF11GRIN1 | |
| SCHEMBL8325974 | 0.78 | NFE2L2 (0.46) | SLC6A2TAAR1CYP2D6CYP3A4MAPT | |
| SCHEMBL8323216 | 0.77 | SLC6A2 (0.46) | SLC6A2TAAR1SLC6A4SLC6A3HTR2A | |
| SCHEMBL8324902 | 0.75 | MAOB (0.49) | SLC6A2TAAR1TRPA1CYP2D6CYP3A4 | |
| SCHEMBL8323792 | 0.74 | SLC6A2 (0.50) | SLC6A2TAAR1TRPA1KIF11CYP2D6 | |
| SCHEMBL8323288 | 0.74 | TAAR1 (0.46) | SLC6A2TAAR1KIF11GRIN1GRIN2B | |
| SCHEMBL8324690 | 0.74 | TAAR1 (0.46) | SLC6A2TAAR1CYP2D6LMNA | |
| SCHEMBL8321777 | 0.73 | GRIN1 (0.45) | SLC6A2TAAR1HTR2AHTR2BGRIN1 | |
| SCHEMBL8327003 | 0.71 | TRPA1 (0.38) | SLC6A2TAAR1TRPA1SLC6A4SLC6A3 |
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-0948496-A2 | SUBSTITUTED PYRIMIDINONE AND PYRIDONE COMPOUNDS AND METHODS OF USE | Amgen inc. (US) | 1999-10-13 | — | — | EP | disclosed |
| WO-1998024780-A2 | SUBSTITUTED PYRIMIDINONE AND PYRIDINONE COMPOUNDS AND THEIR USE | AMGEN INC. (US) | 1998-06-11 | — | — | WO | disclosed |