Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 7/20 | 0.67 |
| ▸ | SCN9A | Q15858 | 7/20 | 0.67 |
| ▸ | SCN5A | Q14524 | 5/20 | 0.67 |
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 6/20 | 0.42 |
| ▸ | RAB9A | P51151 | 6/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | HTR1D | P28221 | 1/20 | 0.41 |
| ▸ | HTR1B | P28222 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4788603 | 0.91 | SCN9A (0.60) | KCNH2SCN9ASCN5ATRPV4MAPK1 | |
| SCHEMBL4788131 | 0.84 | TRPV4 (0.49) | KCNH2SCN9ASCN5ATRPV4NPC1 | |
| SCHEMBL4788106 | 0.82 | SCN9A (0.73) | KCNH2SCN9ASCN5ANPC1RAB9A | |
| SCHEMBL4788881 | 0.80 | SCN9A (0.68) | KCNH2SCN9ASCN5ANPC1RAB9A | |
| SCHEMBL20288009 | 0.80 | SCN9A (1.00) | KCNH2SCN9ASCN5APKM | |
| SCHEMBL8075560 | 0.79 | KCNH2 (0.61) | KCNH2SCN9ASCN5A | |
| SCHEMBL4788731 | 0.79 | SCN9A (0.66) | KCNH2SCN9ASCN5A | |
| SCHEMBL4830493 | 0.77 | SCN9A (0.63) | KCNH2SCN9ASCN5A | |
| SCHEMBL4830490 | 0.77 | SCN9A (0.63) | KCNH2SCN9ASCN5A | |
| SCHEMBL4748122 | 0.77 | SCN9A (0.65) | KCNH2SCN9ASCN5AMAPK1 |
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-2008130322-A1 | NOVEL 5-HETEROCYCLYL-CHROMANE DERIVATIVES FOR THE TREATMENT OF PAIN | ASTRAZENECA AB (SE) | 2008-10-30 | — | — | WO | disclosed |