Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 5/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.38 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 3/20 | 0.38 |
| ▸ | DRD2 | P14416 | 2/20 | 0.38 |
| ▸ | DRD4 | P21917 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2554080 | 1.00 | SMN1; SMN2 (0.45) | SMN1; SMN2CHRNB2CHRNA4OPRM1OPRK1 | |
| SCHEMBL670608 | 0.81 | ALDH1A1 (0.45) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL669922 | 0.81 | ALDH1A1 (0.45) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL670046 | 0.81 | ALDH1A1 (0.45) | SMN1; SMN2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL670045 | 0.80 | SMN1; SMN2 (0.44) | SMN1; SMN2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL16742846 | 0.80 | SMN1; SMN2 (0.44) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL15109995 | 0.78 | BCL2 (0.55) | SMN1; SMN2 | |
| SCHEMBL3899366 | 0.75 | ALDH1A1 (0.50) | CHRNB2CHRNA4OPRM1OPRK1SLC22A1 | |
| SCHEMBL174568 | 0.75 | ALDH1A1 (0.50) | CHRNB2CHRNA4OPRM1OPRK1SLC22A1 | |
| SCHEMBL4495715 | 0.75 | ALDH1A1 (0.50) | CHRNB2CHRNA4OPRM1OPRK1SLC22A1 |
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-2556048-A2 | NOVEL PROCESS FOR PREPARING HIGHLY PURE TAPENTADOL OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF | Actavis Group PTC EHF (IS) | 2013-02-13 | — | — | EP | disclosed |
| WO-2011128784-A2 | NOVEL PROCESS FOR PREPARING HIGHLY PURE TAPENTADOL OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF | ACTAVIS GROUP PTC EHF (IS) | 2011-10-20 | — | — | WO | disclosed |