Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 4/20 | 0.60 |
| ▸ | OPRD1 | P41143 | 4/20 | 0.60 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.60 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.42 |
| ▸ | CTSD | P07339 | 1/20 | 0.41 |
| ▸ | CTSE | P14091 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7486453 | 1.00 | OPRM1 (0.60) | OPRM1OPRD1OPRK1SLC6A4SLC6A2 | |
| Hydrochloric Acid SCHEMBL7487249 | 0.99 | OPRM1 (0.59) | OPRM1OPRD1OPRK1SLC6A4SLC6A2 | |
| Hydrochloric Acid SCHEMBL7487248 | 0.99 | OPRM1 (0.59) | OPRM1OPRD1OPRK1SLC6A4SLC6A2 | |
| SCHEMBL7482382 | 0.90 | OPRM1 (0.56) | OPRM1OPRD1OPRK1SLC6A4SLC6A2 | |
| SCHEMBL7482389 | 0.90 | OPRM1 (0.56) | OPRM1OPRD1OPRK1SLC6A4SLC6A2 | |
| SCHEMBL11398571 | 0.89 | OPRD1 (0.76) | OPRM1OPRD1OPRK1SLC6A4SLC6A2 | |
| SCHEMBL8396855 | 0.89 | OPRD1 (0.76) | OPRM1OPRD1OPRK1SLC6A4SLC6A2 | |
| SCHEMBL8396856 | 0.89 | OPRD1 (0.76) | OPRM1OPRD1OPRK1SLC6A4SLC6A2 | |
| Hydrochloric Acid SCHEMBL7496002 | 0.89 | OPRM1 (0.56) | OPRM1OPRD1OPRK1SLC6A4SLC6A2 | |
| Hydrochloric Acid SCHEMBL7496005 | 0.89 | OPRM1 (0.56) | OPRM1OPRD1OPRK1SLC6A4SLC6A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0712402-B1 | HYDROISOQUINOLINE DERIVATIVES | SMITHKLINE BEECHAM SPA (IT) | 2002-04-10 | — | — | EP | disclosed |
| EP-0854868-A1 | SUBSTITUTED HYDROISOQUINOLINE DERIVATIVES AND THEIR USE AS PHARMACEUTICALS | Smithkline Beecham S.p.A. (IT) | 1998-07-29 | — | — | EP | disclosed |
| WO-1997010216-A1 | SUBSTITUTED HYDROISOQUINOLINE DERIVATIVES AND THEIR USE AS PHARMACEUTICALS | SMITHKLINE BEECHAM S.P.A. (IT) | 1997-03-20 | — | — | WO | disclosed |