Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.50 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | ESRRA | P11474 | 1/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.42 |
| ▸ | HTR2A | P28223 | 2/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.41 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL19563653 | 0.87 | ALDH1A1 (0.53) | L3MBTL1RAB9AESRRAALDH1A1MAPT | |
| SCHEMBL18570715 | 0.86 | SCN8A (0.49) | SCN8ASCN10AL3MBTL1RAB9AALDH1A1 | |
| SCHEMBL18570365 | 0.86 | SCN8A (0.49) | SCN8AL3MBTL1RAB9AFFAR1ALDH1A1 | |
| SCHEMBL18570517 | 0.85 | L3MBTL1 (0.62) | SCN8ASCN10AL3MBTL1RAB9AALDH1A1 | |
| SCHEMBL18570625 | 0.83 | SCN8A (0.50) | SCN8ASCN10ARAB9AALDH1A1MAPT | |
| SCHEMBL5837555 | 0.83 | HTR2A (0.56) | L3MBTL1RAB9AFFAR1ALDH1A1SLC6A4 | |
| SCHEMBL19563643 | 0.83 | SCN8A (0.47) | SCN8ASCN10AESRRAFFAR1SLC6A4 | |
| SCHEMBL19524146 | 0.81 | KMT2A (0.49) | SCN8ASCN10AESRRAFFAR1MAPT | |
| SCHEMBL19563632 | 0.81 | ALDH1A1 (0.50) | RAB9AALDH1A1MAPTNPSR1SLC6A4 | |
| SCHEMBL19563582 | 0.81 | ESRRA (0.45) | ESRRAALDH1A1MAPTSLC6A4KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3022175-B1 | SULFONAMIDES AS MODULATORS OF SODIUM CHANNELS | VERTEX PHARMA (US) | 2017-11-08 | — | — | EP | disclosed |
| EP-2953931-B1 | PYRIDONE AMIDES AS MODULATORS OF SODIUM CHANNELS | VERTEX PHARMA (US) | 2017-03-01 | — | — | EP | disclosed |