Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 11/20 | 0.58 |
| ▸ | MAOA | P21397 | 9/20 | 0.58 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.56 |
| ▸ | TOP1 | P11387 | 1/20 | 0.52 |
| ▸ | EGFR | P00533 | 1/20 | 0.49 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.49 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.49 |
| ▸ | GRM5 | P41594 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.48 |
| ▸ | RELA | Q04206 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL29289947 | 1.00 | MAOB (0.58) | MAOBMAOAHRH3TOP1EGFR | |
| SCHEMBL25920261 | 0.79 | AOC3 (0.44) | HRH3NPC1ALDH1A1RAB9A | |
| SCHEMBL11026437 | 0.79 | MAOB (0.58) | MAOBMAOAHRH3TOP1 | |
| SCHEMBL31409522 | 0.78 | CYP2C9 (0.74) | — | |
| SCHEMBL25316116 | 0.78 | AOC3 (0.44) | HRH3 | |
| SCHEMBL30507225 | 0.78 | AOC3 (0.44) | HRH3 | |
| SCHEMBL13355127 | 0.78 | AOC3 (0.44) | HRH3 | |
| SCHEMBL25921175 | 0.77 | BRS3 (0.50) | MAOBMAOAEGFRGRM5ALDH1A1 | |
| SCHEMBL3759785 | 0.77 | MAOB (0.74) | MAOBMAOAHRH3TOP1GRM5 | |
| SCHEMBL16519571 | 0.77 | AOC3 (0.43) | HRH3 |
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-113563245-B | Substituted pyrrolidines and their use in medicine | 广东东阳光药业股份有限公司 | 2024-10-15 | — | — | CN | disclosed |