Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 11/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 10/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 7/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.34 |
| ▸ | HRH1 | P35367 | 3/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.34 |
| ▸ | HRH2 | P25021 | 2/20 | 0.34 |
| ▸ | HTR2A | P28223 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | THPO | P40225 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | SCN1A | P35498 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6650426 | 0.76 | HRH3 (0.33) | SLC6A4HRH3SLC6A2SLC6A3 | |
| SCHEMBL4905451 | 0.75 | HRH3 (0.39) | SLC6A4HRH3SLC6A2SLC6A3CHRM2 | |
| SCHEMBL5599833 | 0.74 | HRH3 (0.39) | SLC6A4HRH3SLC6A2SLC6A3 | |
| SCHEMBL5924545 | 0.72 | HRH3 (0.43) | SLC6A4HRH3SLC6A2SLC6A3CHRM2 | |
| SCHEMBL4910298 | 0.71 | HRH3 (0.40) | SLC6A4HRH3SLC6A2SLC6A3CHRM2 | |
| SCHEMBL5602140 | 0.70 | HRH3 (0.36) | SLC6A4HRH3SLC6A2SLC6A3CHRM2 | |
| SCHEMBL6648867 | 0.70 | SLC6A4 (0.32) | SLC6A4HRH3SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL5599393 | 0.68 | PSMB1 (0.40) | SLC6A4HRH3SLC6A2SIGMAR1LMNA | |
| SCHEMBL5601418 | 0.66 | FFAR1 (0.44) | SLC6A4HRH3L3MBTL1 | |
| SCHEMBL4910626 | 0.64 | HRH3 (0.51) | SLC6A4HRH3SLC6A2SLC6A3CHRM2 |
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-1755678-A2 | ACTIVE SUBSTANCE COMBINATION OF A CARBINOL COMPOUND AND AN OPIOID | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2007-02-28 | — | — | EP | disclosed |
| WO-2005097192-A2 | ACTIVE SUBSTANCE COMBINATION OF A CARBINOL COMPOUND AND AN OPIOID | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2005-10-20 | — | — | WO | disclosed |