Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.42 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.42 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.42 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.40 |
| ▸ | ACP3 | P15309 | 1/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.36 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | FBP1 | P09467 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8326387 | 0.85 | TAAR1 (0.41) | TP53TDP1TAAR1AOC3TRPA1 | |
| SCHEMBL14910878 | 0.84 | TAAR1 (0.50) | TAAR1AOC3TRPA1RIPK1 | |
| SCHEMBL8324378 | 0.82 | SCN4A (0.44) | TP53TDP1NPC1CASP3SENP8 | |
| SCHEMBL8328586 | 0.82 | ALDH1A1 (0.46) | TAAR1ACP3RELA | |
| SCHEMBL8322584 | 0.82 | MAOA (0.49) | NPC1TAAR1AOC3MAPT | |
| SCHEMBL8325764 | 0.81 | TAAR1 (0.44) | TAAR1AOC3TRPA1RIPK1ACHE | |
| SCHEMBL8324977 | 0.78 | IDO1 (0.49) | NPC1ACP3FBP1MAPTRAB9A | |
| SCHEMBL16956846 | 0.77 | TP53 (0.52) | TP53TDP1NPC1CASP3SENP8 | |
| SCHEMBL8325622 | 0.72 | NFE2L2 (0.44) | NPC1TAAR1AOC3TRPA1RIPK1 | |
| SCHEMBL8327482 | 0.72 | CYP3A4 (0.42) | NPC1TAAR1TRPA1RAB9ASMN1; SMN2 |
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 |