Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.42 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.31 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.30 |
| ▸ | PRKCG | P05129 | 1/20 | 0.30 |
| ▸ | PRKCB | P05771 | 1/20 | 0.30 |
| ▸ | PRKCA | P17252 | 1/20 | 0.30 |
| ▸ | PRKCH | P24723 | 1/20 | 0.30 |
| ▸ | PRKCI | P41743 | 1/20 | 0.30 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.30 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.30 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.30 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.30 |
| ▸ | PRKD1 | Q15139 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4767155 | 1.00 | CHRM2 (0.42) | CHRM2CHRM4CHRM5CHRM3ALDH1A1 | |
| SCHEMBL8928379 | 0.98 | ALDH1A1 (0.43) | CHRM2CHRM4CHRM5CHRM3ALDH1A1 | |
| Methyl Alcohol SCHEMBL28701156 | 0.96 | CHRM2 (0.44) | CHRM2CHRM4CHRM5CHRM3ALDH1A1 | |
| SCHEMBL4667952 | 0.94 | CHRM2 (0.44) | CHRM2CHRM4CHRM5CHRM3ALDH1A1 | |
| Oxirane SCHEMBL9245218 | 0.87 | ALDH1A1 (0.52) | ALDH1A1THRBSMN1; SMN2EPHX1PRKD3 | |
| SCHEMBL26986006 | 0.85 | — | — | |
| SCHEMBL928477 | 0.85 | — | — | |
| SCHEMBL8079198 | 0.83 | CHRM2 (0.45) | CHRM2CHRM4CHRM5CHRM3ALDH1A1 | |
| SCHEMBL8071010 | 0.83 | CHRM2 (0.45) | CHRM2CHRM4CHRM5CHRM3ALDH1A1 | |
| Water SCHEMBL5064656 | 0.83 | CHRM2 (0.45) | CHRM2CHRM4CHRM5CHRM3ALDH1A1 |
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-1942892-A1 | SOLID DISPERSIONS OF OPIOID ANTAGONISTS | Adolor Corporation (US) | 2008-07-16 | — | — | EP | disclosed |
| WO-2007044713-A1 | SOLID DISPERSIONS OF OPIOID ANTAGONISTS | ADOLOR CORPORATION (US) | 2007-04-19 | — | — | WO | disclosed |