Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 8/20 | 0.73 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.49 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | MALT1 | Q9UDY8 | 2/20 | 0.45 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.43 |
| ▸ | LCK | P06239 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL18172201 | 0.93 | SCN9A (0.72) | SCN9AKDM4EHPGDHTTRXFP1 | |
| SCHEMBL18172156 | 0.79 | SCN9A (0.77) | SCN9ARXFP1SCN5AKMT2AMAPK14 | |
| SCHEMBL18172027 | 0.77 | MAPK14 (0.59) | SCN9AHPGDSCN5AALDH1A1KMT2A | |
| SCHEMBL18172073 | 0.76 | HPGD (0.61) | SCN9AKDM4EHPGDHTTSCN5A | |
| SCHEMBL18172235 | 0.74 | SCN9A (0.72) | SCN9ASCN5A | |
| SCHEMBL18172018 | 0.74 | SCN9A (0.72) | SCN9ASCN5AMAPK14 | |
| SCHEMBL18172103 | 0.73 | SCN9A (0.65) | SCN9AKDM4EHPGDSCN5AMALT1 | |
| SCHEMBL18172037 | 0.73 | SCN9A (0.75) | SCN9ASCN5AMAPK14 | |
| SCHEMBL18172237 | 0.73 | SCN9A (0.72) | SCN9ASCN5AMAPK14 | |
| SCHEMBL18172258 | 0.72 | SCN9A (0.76) | SCN9AKDM4EHPGDHTTSCN5A |
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-3286178-A1 | AMINO-SUBSTITUTED HETEROCYCLIC DERIVATIVES AS SODIUM CHANNEL INHIBITORS | Almirall S.A. (ES) | 2018-02-28 | — | — | EP | disclosed |
| WO-2016170009-A1 | AMINO-SUBSTITUTED HETEROCYCLIC DERIVATIVES AS SODIUM CHANNEL INHIBITORS | ALMIRALL, S.A. (ES) | 2016-10-27 | — | — | WO | disclosed |