Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.35 |
| ▸ | DRD1 | P21728 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | ACSL1 | P33121 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2658102 | 1.00 | MAOA (0.46) | MAOAMAOBMAPKAPK2DRD1NPC1 | |
| SCHEMBL115187 | 0.83 | MAOA (0.50) | MAOAMAOBMAPKAPK2DRD1NPC1 | |
| SCHEMBL6599502 | 0.76 | MAOA (0.42) | MAOAMAOBMAPKAPK2NPC1LMNA | |
| SCHEMBL6599506 | 0.74 | MAOA (0.43) | MAOAMAOBMAPKAPK2DRD1NPC1 | |
| SCHEMBL28660534 | 0.71 | MAOA (0.40) | MAOAMAOBMAPKAPK2DRD1 | |
| SCHEMBL11297104 | 0.71 | MAOA (0.40) | MAOAMAOBMAPKAPK2DRD1 | |
| SCHEMBL31673358 | 0.71 | MAOA (0.50) | MAOAMAOBDRD1GAANPSR1 | |
| SCHEMBL29453995 | 0.70 | MAOA (0.64) | MAOAMAOBMAPKAPK2NPC1LMNA | |
| SCHEMBL23535453 | 0.68 | ALOX5 (0.46) | DRD1LMNAGAANPSR1TDP1 | |
| Xanthene SCHEMBL30586075 | 0.67 | MAOA (1.00) | MAOAMAOBMAPKAPK2NPC1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-115667264-A | Novel imidazo-pyrazine derivatives | 豪夫迈·罗氏有限公司 | 2023-01-31 | — | — | CN | disclosed |