Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 6/20 | 0.45 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.41 |
| ▸ | PDE2A | O00408 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.39 |
| ▸ | SCN1A | P35498 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.38 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.38 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.38 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.38 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.38 |
| ▸ | ALPL | P05186 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27913866 | 0.92 | CTSD (0.40) | P2RX7SCN3AROCK2SCN5ASCN9A | |
| SCHEMBL28093971 | 0.89 | P2RX7 (0.43) | P2RX7SCN3APDE2AEPHX2CACNA1H | |
| SCHEMBL27913624 | 0.88 | SCN3A (0.48) | SCN3AROCK2SCN1AKCNH2SCN5A | |
| Pyrazinamide SCHEMBL28833290 | 0.85 | P2RX7 (0.43) | P2RX7SCN3APDE2AEPHX2CACNA1H | |
| SCHEMBL27931776 | 0.84 | VNN1 (0.46) | P2RX7NTRK1 | |
| SCHEMBL15432477 | 0.82 | PDE2A (0.48) | P2RX7PDE2AEPHX2CACNA1H | |
| SCHEMBL27913577 | 0.81 | VNN1 (0.53) | P2RX7 | |
| SCHEMBL28833323 | 0.81 | CTSD (0.39) | P2RX7SCN3ASCN1AKCNH2SCN5A | |
| SCHEMBL27931748 | 0.80 | L3MBTL1 (0.58) | P2RX7SCN3AEPHX2ROCK2SCN1A | |
| SCHEMBL27931758 | 0.79 | HDAC3 (0.40) | P2RX7EPHX2ROCK2SCN9AROCK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103249721-A | Arylamine Derivatives as TTX-S Blockers | RAQUALIA PHARMA INC | 2013-08-14 | — | — | CN | claimed |
| CN-103249721-A | Arylamine Derivatives as TTX-S Blockers | RAQUALIA PHARMA INC | 2013-08-14 | — | — | CN | disclosed |