Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.55 |
| ▸ | MAPT | P10636 | 6/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL13475542 | 0.82 | TSHR (0.47) | MAPTHPGDALDH1A1CYP2C9POLB | |
| SCHEMBL13499940 | 0.82 | NPSR1 (0.57) | NPSR1MAPTL3MBTL1RAB9AATM | |
| SCHEMBL171742 | 0.81 | NPSR1 (0.56) | NPSR1MAPTL3MBTL1RAB9AATM | |
| SCHEMBL14129187 | 0.81 | NPSR1 (0.64) | NPSR1MAPTL3MBTL1RAB9AATM | |
| SCHEMBL2611833 | 0.80 | MAPT (0.75) | NPSR1MAPTL3MBTL1RAB9AATM | |
| SCHEMBL20206851 | 0.79 | SLC6A4 (0.37) | NPSR1MAPTRAB9ANPC1ALDH1A1 | |
| SCHEMBL3739646 | 0.78 | AR (0.48) | ALDH1A1MAPK1MRGPRX4 | |
| SCHEMBL5703181 | 0.78 | ALDH1A1 (0.44) | MAPTL3MBTL1HPGDALDH1A1MAPK1 | |
| SCHEMBL12677545 | 0.77 | NPSR1 (0.68) | NPSR1MAPTL3MBTL1RAB9AATM | |
| SCHEMBL12677544 | 0.77 | NPSR1 (0.68) | NPSR1MAPTL3MBTL1RAB9AATM |
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 |