Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 6/20 | 0.57 |
| ▸ | MAOA | P21397 | 4/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | PPARD | Q03181 | 1/20 | 0.40 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6685482 | 0.91 | MAOB (0.47) | MAOBMAOAPOLBTP53SCN9A | |
| SCHEMBL6685476 | 0.91 | MAOB (0.47) | MAOBMAOAPOLBTP53SCN9A | |
| SCHEMBL6689256 | 0.87 | SCN9A (0.53) | MAOBMAOAPOLBSCN9AHPGD | |
| SCHEMBL6689254 | 0.87 | SCN9A (0.53) | MAOBMAOAPOLBSCN9AHPGD | |
| SCHEMBL6688731 | 0.84 | CD274 (0.45) | POLBMEN1KMT2A | |
| SCHEMBL6688726 | 0.84 | CD274 (0.45) | POLBMEN1KMT2A | |
| SCHEMBL6687667 | 0.79 | MAOB (0.59) | MAOBMAOASCN9A | |
| SCHEMBL6687664 | 0.79 | MAOB (0.59) | MAOBMAOASCN9A | |
| SCHEMBL6690944 | 0.79 | MAOB (0.48) | MAOBMAOATP53 | |
| SCHEMBL6687864 | 0.78 | MAOB (0.45) | MAOBMAOAPOLBMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004087125-A1 | AMINO ACID DERIVATIVES AS INHIBITORS OF MAMMALIAN SODIUM CHANNELS | IONIX PHARMACEUTICALS LIMITED (GB) | 2004-10-14 | — | — | WO | disclosed |