Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.49 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.42 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7380896 | 0.93 | SIGMAR1 (0.51) | SIGMAR1 | |
| SCHEMBL27781945 | 0.75 | SLC18A3 (0.65) | OPRM1OPRK1 | |
| SCHEMBL10263767 | 0.73 | SLC18A3 (0.67) | — | |
| SCHEMBL9306818 | 0.72 | SIGMAR1 (0.64) | SIGMAR1OPRM1 | |
| Hydrochloric Acid SCHEMBL9308470 | 0.71 | SIGMAR1 (0.67) | SIGMAR1OPRM1 | |
| SCHEMBL5462211 | 0.70 | SLC18A3 (0.58) | OPRM1OPRK1OPRL1 | |
| SCHEMBL9308002 | 0.70 | SIGMAR1 (0.55) | SIGMAR1OPRM1 | |
| SCHEMBL31628898 | 0.69 | ALDH1A1 (0.48) | OPRM1OPRK1OPRL1 | |
| SCHEMBL16745554 | 0.69 | HRH3 (0.54) | SIGMAR1OPRM1OPRK1OPRL1 | |
| SCHEMBL19810796 | 0.67 | SLC18A3 (0.54) | SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5294618-A | Psychological disorders | MERCK SHARP & DOHME LIMITED (GB) | 1994-03-15 | — | — | US | disclosed |
| EP-0410535-A2 | Octahydrobenzisoquinoline derivatives as antipsychotic agents | MERCK SHARP & DOHME LTD. (GB) | 1991-01-30 | — | — | EP | disclosed |