Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 4/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CCR3 | P51677 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL7695908 | 0.90 | HTR2A (0.43) | HTR2AKCNH2HTR2CACHERECQL | |
| SCHEMBL7700571 | 0.83 | ACHE (0.42) | HTR2AKCNH2HTR2CACHECCR3 | |
| SCHEMBL7697015 | 0.81 | KCNH2 (0.42) | HTR2AKCNH2HTR2CACHEDRD2 | |
| SCHEMBL7694829 | 0.80 | HTR2A (0.46) | HTR2AKCNH2HTR2CACHECYP2D6 | |
| SCHEMBL7707462 | 0.78 | ACHE (0.44) | HTR2AKCNH2HTR2CACHECCR3 | |
| SCHEMBL7700744 | 0.78 | KCNH2 (0.40) | HTR2AKCNH2HTR2CACHE | |
| SCHEMBL7698615 | 0.74 | LTA4H (0.48) | HTR2AACHEMEN1KMT2A | |
| SCHEMBL7698618 | 0.73 | HTR2A (0.41) | HTR2AKCNH2ACHEMEN1KMT2A | |
| SCHEMBL7705775 | 0.73 | KDM4E (0.49) | ACHECCR3 | |
| SCHEMBL16197363 | 0.73 | CYP2D6 (0.52) | RECQLSMN1; SMN2CYP2D6MEN1KMT2A |
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-2002046187-A1 | ANALGESIC DIAZABICYCLO[4.3.0]NONANES | SEPRACOR, INC. (US) | 2002-06-13 | — | — | WO | disclosed |