Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 12/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 10/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 5/20 | 0.37 |
| ▸ | SLC22A1 | O15245 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11115661 | 0.83 | KDM1A (0.40) | KDM1ASLC6A4SLC6A2OPRM1SLC22A1 | |
| SCHEMBL11079094 | 0.82 | SLC6A4 (0.36) | KDM1ASLC6A4SLC6A2OPRM1SLC22A1 | |
| SCHEMBL11081030 | 0.82 | SLC6A4 (0.39) | KDM1ASLC6A4SLC6A2OPRM1SLC22A1 | |
| SCHEMBL11089517 | 0.81 | ALDH1A1 (0.47) | SLC6A4SLC6A2OPRM1SLC22A1KMT2A | |
| SCHEMBL11090776 | 0.81 | KDM1A (0.42) | KDM1ASLC6A4SLC6A2OPRM1SLC22A1 | |
| SCHEMBL11086716 | 0.81 | SLC6A4 (0.40) | KDM1ASLC6A4SLC6A2OPRM1SLC22A1 | |
| SCHEMBL11082812 | 0.81 | SLC6A4 (0.40) | KDM1ASLC6A4SLC6A2OPRM1SLC22A1 | |
| Hydrochloric Acid SCHEMBL11079091 | 0.81 | ALDH1A1 (0.46) | SLC6A4SLC6A2OPRM1SLC22A1KMT2A | |
| SCHEMBL11079087 | 0.81 | ALDH1A1 (0.40) | KDM1ASLC6A4SLC6A2OPRM1SLC22A1 | |
| SCHEMBL11087953 | 0.80 | KMT2A (0.44) | KDM1ASLC6A4SLC6A2OPRM1SLC22A1 |
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-0033156-B1 | 1-PHENYL-2-CYCLOHEXENE-1-ALKYLAMINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THEM | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1984-10-17 | — | — | EP | disclosed |
| US-4448991-A | ANALGESICS | HOFFMANN-LA ROCHE INC. (US) | 1984-05-15 | — | — | US | disclosed |
| US-4336268-A | Cyclohexene derivative analgesics | HOFFMANN-LA ROCHE INC. (US) | 1982-06-22 | — | — | US | disclosed |
| EP-0033156-A2 | 1-Phenyl-2-cyclohexene-1-alkylamine derivatives, process for their preparation and medicines containing them | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1981-08-05 | — | — | EP | disclosed |