Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.65 |
| ▸ | MAOB | P27338 | 11/20 | 0.58 |
| ▸ | KEAP1 | Q14145 | 3/20 | 0.58 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.58 |
| ▸ | BCHE | P06276 | 1/20 | 0.54 |
| ▸ | ACHE | P22303 | 1/20 | 0.54 |
| ▸ | APP | P05067 | 1/20 | 0.53 |
| ▸ | MAOA | P21397 | 2/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL31026429 | 0.96 | PTGS2 (0.61) | PTGS2MAOBKEAP1NFE2L2BCHE | |
| SCHEMBL31026420 | 0.91 | PTGS2 (0.58) | PTGS2MAOBAPPMAOAPTGS1 | |
| SCHEMBL31026445 | 0.90 | MAOB (0.69) | PTGS2MAOBBCHEACHEMAOA | |
| SCHEMBL31026427 | 0.89 | MAOB (0.70) | PTGS2MAOBBCHEACHEMAOA | |
| SCHEMBL31026423 | 0.89 | MAOB (0.70) | PTGS2MAOBBCHEACHEMAOA | |
| SCHEMBL31026421 | 0.89 | MAOB (0.68) | PTGS2MAOBBCHEACHEAPP | |
| SCHEMBL31026419 | 0.85 | PTGS2 (0.56) | PTGS2MAOBBCHEACHEAPP | |
| SCHEMBL28603613 | 0.78 | PTGS2 (0.59) | PTGS2MAOBMAOAPTGS1 | |
| SCHEMBL28684813 | 0.77 | MAOB (0.71) | MAOBKEAP1NFE2L2BCHEACHE | |
| SCHEMBL29416758 | 0.77 | MAOB (0.71) | MAOBKEAP1NFE2L2BCHEACHE |
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-118388430-A | Pterocarpus astragalus chalcone compound, preparation method and medical application thereof | 安徽中医药大学 | 2024-07-26 | — | — | CN | disclosed |