Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.44 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | NOS3 | P29474 | 1/20 | 0.43 |
| ▸ | NOS1 | P29475 | 1/20 | 0.43 |
| ▸ | NOS2 | P35228 | 1/20 | 0.43 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8325444 | 0.85 | TAAR1 (0.46) | TAAR1SLC18A2SIGMAR1SMN1; SMN2PPARG | |
| SCHEMBL8326774 | 0.83 | NPC1 (0.52) | TAAR1SLC18A2SIGMAR1NOS3NOS1 | |
| SCHEMBL8322850 | 0.83 | NFE2L2 (0.45) | TAAR1SLC18A2SIGMAR1NFE2L2PPARG | |
| SCHEMBL8323399 | 0.81 | LTA4H (0.50) | TAAR1SLC18A2SIGMAR1ALDH1A1PPARG | |
| SCHEMBL8322029 | 0.80 | CYP3A4 (0.40) | TAAR1SLC18A2SIGMAR1NOS2SMN1; SMN2 | |
| SCHEMBL8326594 | 0.78 | NFE2L2 (0.44) | TAAR1SLC18A2SIGMAR1NOS3NOS1 | |
| SCHEMBL8327429 | 0.75 | TAAR1 (0.42) | TAAR1SLC18A2SIGMAR1ALDH1A1POLB | |
| SCHEMBL8323592 | 0.74 | NOS3 (0.40) | SIGMAR1NOS3NOS1NOS2NFE2L2 | |
| SCHEMBL8324981 | 0.74 | GRIN1 (0.43) | TAAR1SLC18A2SIGMAR1ALDH1A1GRIN1 | |
| SCHEMBL8325015 | 0.74 | MAOA (0.45) | TAAR1SLC18A2SIGMAR1MAPTMEN1 |
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 |