Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.51 |
| ▸ | MAOA | P21397 | 3/20 | 0.48 |
| ▸ | MAOB | P27338 | 3/20 | 0.48 |
| ▸ | CD274 | Q9NZQ7 | 6/20 | 0.47 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.46 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.46 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | PPARD | Q03181 | 1/20 | 0.44 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.41 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6690365 | 1.00 | SPHK1 (0.51) | SPHK1MAOAMAOBCD274SCN3A | |
| SCHEMBL6169023 | 0.78 | SCN3A (0.75) | SPHK1MAOAMAOBCD274SCN3A | |
| SCHEMBL6169037 | 0.78 | SCN3A (0.75) | SPHK1MAOAMAOBCD274SCN3A | |
| SCHEMBL4844700 | 0.74 | SPHK1 (0.59) | SPHK1MAOAMAOBCD274SCN3A | |
| SCHEMBL6170788 | 0.74 | MAOB (0.72) | SPHK1MAOAMAOBSCN3A | |
| SCHEMBL6170791 | 0.74 | MAOB (0.72) | SPHK1MAOAMAOBSCN3A | |
| SCHEMBL7309417 | 0.71 | SPHK1 (0.63) | SPHK1MAOAMAOBCD274SCN3A | |
| SCHEMBL9151576 | 0.70 | MAOB (0.64) | SPHK1MAOAMAOBCD274SCN3A | |
| SCHEMBL9147565 | 0.70 | MAOB (0.64) | SPHK1MAOAMAOBCD274SCN3A | |
| SCHEMBL408684 | 0.70 | SPHK1 (0.71) | SPHK1MAOAMAOBCD274SCN3A |
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 |