Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 11/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 10/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL2449 | 0.98 | SLC6A4 (0.43) | SLC6A4SLC6A3SLC6A2OPRM1OPRL1 | |
| Hydrochloric Acid SCHEMBL2434 | 0.83 | SLC6A4 (0.54) | SLC6A4SLC6A3SLC6A2OPRK1ALDH1A1 | |
| SCHEMBL1923 | 0.82 | CTSL (0.37) | SLC6A4SLC6A3SLC6A2OPRM1OPRL1 | |
| SCHEMBL10981709 | 0.78 | SLC6A4 (0.73) | SLC6A4SLC6A3SLC6A2 | |
| Hydrochloric Acid SCHEMBL2049 | 0.77 | SLC6A4 (0.71) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL7794188 | 0.77 | SLC6A4 (0.49) | SLC6A4SLC6A3SLC6A2OPRM1OPRL1 | |
| Hydrochloric Acid SCHEMBL1902 | 0.75 | SLC6A4 (0.51) | SLC6A4SLC6A3SLC6A2OPRK1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL5310388 | 0.73 | SLC6A4 (0.40) | SLC6A4SLC6A3SLC6A2OPRM1OPRK1 | |
| SCHEMBL13849911 | 0.69 | OPRM1 (0.44) | SLC6A3SLC6A2OPRM1OPRL1OPRD1 | |
| SCHEMBL14402615 | 0.69 | OPRM1 (0.44) | SLC6A3SLC6A2OPRM1OPRL1OPRD1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4814352-A | ANTIDEPRESSANT CYCLOBUTYL BENZYLAMINE | THE BOOTS COMPANY PLC (GB) | 1989-03-21 | — | — | US | disclosed |
| US-4806570-A | ANTIDEPRESSANTS | THE BOOTS COMPANY PLC (GB) | 1989-02-21 | — | — | US | disclosed |
| US-4767790-A | ANTIDEPRESSANTS | THE BOOTS COMPANY PLC (GB) | 1988-08-30 | — | — | US | disclosed |
| US-4746680-A | ANTIDEPRESSANTS | THE BOOTS COMPANY P.L.C. (GB) | 1988-05-24 | — | — | US | disclosed |
| US-4522828-A | CYCLOBUTYLALKYLAMINE COMPOUNDS, ANTIDEPRESSANTS | THE BOOTS COMPANY PLC (GB) | 1985-06-11 | — | — | US | disclosed |