Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 3/20 | 0.53 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.53 |
| ▸ | SLC6A4 | P31645 | 8/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 8/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 6/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL4837893 | 0.93 | CHRM2 (0.54) | CHRM2CHRM1SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL4839675 | 0.93 | CHRM2 (0.45) | CHRM2CHRM1SLC6A4SLC6A3SLC6A2 | |
| Hydrochloric Acid SCHEMBL8529509 | 0.92 | CHRM2 (0.53) | CHRM2CHRM1SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL649003 | 0.89 | SLC6A4 (0.45) | CHRM2CHRM1SLC6A4SLC6A3SLC6A2 | |
| Hydrochloric Acid SCHEMBL7368877 | 0.88 | SLC6A4 (0.44) | CHRM2CHRM1SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL4837226 | 0.87 | SLC6A4 (0.45) | CHRM2CHRM1SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL4831862 | 0.86 | SLC6A4 (0.44) | CHRM2CHRM1SLC6A4SLC6A3SLC6A2 | |
| Hydrochloric Acid SCHEMBL8529249 | 0.86 | SLC6A4 (0.44) | CHRM2CHRM1SLC6A4SLC6A3SLC6A2 | |
| Hydrochloric Acid SCHEMBL7374494 | 0.85 | SLC6A4 (0.43) | CHRM2CHRM1SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL4834581 | 0.84 | SLC6A4 (0.47) | CHRM2CHRM1SLC6A4SLC6A3SLC6A2 |
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-0715620-A1 | 1-ARYLCYCLOALKYL SULPHIDES, SULPHOXIDES AND SULPHONES FOR THE TREATMENT OF DEPRESSION, ANXIETY AND PARKINSON'S DISEASE | Knoll AG (DE) | 1996-06-12 | — | — | EP | disclosed |
| WO-1994026704-A1 | 1-ARYLCYCLOALKYL SULPHIDES, SULPHOXIDES AND SULPHONES FOR THE TREATMENT OF DEPRESSION, ANXIETY AND PARKINSON'S DISEASE | THE BOOTS COMPANY PLC (GB) | 1994-11-24 | — | — | WO | disclosed |