Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.36 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | CCR2 | P41597 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL669527 | 0.85 | HTR6 (0.38) | ALDH1A1 | |
| SCHEMBL669373 | 0.80 | KCNH2 (0.38) | HTR2AALDH1A1AOC3TAAR1KIF11 | |
| SCHEMBL14984858 | 0.80 | KCNH2 (0.38) | HTR2AALDH1A1AOC3TAAR1KIF11 | |
| SCHEMBL669655 | 0.80 | KCNH2 (0.38) | HTR2AALDH1A1AOC3TAAR1KIF11 | |
| SCHEMBL14974361 | 0.80 | KCNH2 (0.38) | HTR2AALDH1A1AOC3TAAR1KIF11 | |
| SCHEMBL14775635 | 0.80 | ALDH1A1 (0.36) | CALM1CAMKK2ALDH1A1AOC3 | |
| SCHEMBL14974802 | 0.77 | HTR2A (0.34) | HTR2AALDH1A1AOC3TAAR1KIF11 | |
| SCHEMBL14987837 | 0.76 | HTR2A (0.37) | HTR2AALDH1A1AOC3TAAR1KIF11 | |
| SCHEMBL669922 | 0.75 | ALDH1A1 (0.45) | CALM1CAMKK2ALDH1A1AOC3 | |
| SCHEMBL670608 | 0.75 | ALDH1A1 (0.45) | CALM1CAMKK2ALDH1A1AOC3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2606030-A1 | PROCESS FOR THE PREPARATION OF TAPENTADOL | Indoco Remedies Limited (IN) | 2013-06-26 | — | — | EP | claimed |
| WO-2012023147-A1 | PROCESS FOR THE PREPARATION OF TAPENTADOL | INDOCO REMEDIES LIMITED (IN) | 2012-02-23 | — | — | WO | claimed |
| EP-2606030-A1 | PROCESS FOR THE PREPARATION OF TAPENTADOL | Indoco Remedies Limited (IN) | 2013-06-26 | — | — | EP | disclosed |
| WO-2012023147-A1 | PROCESS FOR THE PREPARATION OF TAPENTADOL | INDOCO REMEDIES LIMITED (IN) | 2012-02-23 | — | — | WO | disclosed |