Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 2/20 | 0.76 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.55 |
| ▸ | MAOB | P27338 | 8/20 | 0.54 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.53 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.53 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.53 |
| ▸ | MAOA | P21397 | 1/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL28564453 | 1.00 | SCN9A (0.76) | SCN9ASCN3AMAOBPARP15PARP14 | |
| SCHEMBL964122 | 0.93 | SCN9A (0.79) | SCN9ASCN3AMAOBPARP15PARP14 | |
| Ralfinamide SCHEMBL962699 | 0.86 | SCN9A (1.00) | SCN9ASCN3AMAOBPARP15PARP14 | |
| Ralfinamide SCHEMBL29379049 | 0.86 | SCN9A (1.00) | SCN9ASCN3AMAOBPARP15PARP14 | |
| Ralfinamide SCHEMBL67329 | 0.86 | SCN9A (1.00) | SCN9ASCN3AMAOBPARP15PARP14 | |
| Ralfinamide SCHEMBL67328 | 0.86 | SCN9A (1.00) | SCN9ASCN3AMAOBPARP15PARP14 | |
| Ralfinamide SCHEMBL1697252 | 0.85 | SCN9A (0.98) | SCN9ASCN3AMAOBPARP15PARP14 | |
| Ralfinamide SCHEMBL1697253 | 0.85 | SCN9A (0.98) | SCN9ASCN3AMAOBPARP15PARP14 | |
| SCHEMBL963787 | 0.83 | SCN9A (0.85) | SCN9ASCN3AMAOBPARP15PARP14 | |
| Ralfinamide SCHEMBL1697229 | 0.83 | SCN9A (0.91) | SCN9ASCN3AMAOBPARP15PARP14 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112716927-B | Alpha-amino amide compound and preparation method and application thereof | 复旦大学 | 2022-10-14 | — | — | CN | disclosed |
| CN-112716927-A | Alpha-amino amide compound and preparation method and application thereof | 复旦大学 | 2021-04-30 | — | — | CN | disclosed |