Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 8/20 | 0.62 |
| ▸ | OPRM1 | P35372 | 7/20 | 0.62 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.62 |
| ▸ | DRD2 | P14416 | 7/20 | 0.44 |
| ▸ | LTA4H | P09960 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11224595 | 0.88 | SIGMAR1 (0.61) | SIGMAR1OPRM1KCNH2DRD2 | |
| SCHEMBL11231772 | 0.85 | SIGMAR1 (0.63) | SIGMAR1OPRM1KCNH2DRD2LTA4H | |
| SCHEMBL11220600 | 0.83 | DRD2 (0.46) | SIGMAR1OPRM1KCNH2DRD2 | |
| SCHEMBL11234698 | 0.82 | OPRM1 (0.47) | SIGMAR1OPRM1KCNH2DRD2 | |
| SCHEMBL11236302 | 0.81 | SIGMAR1 (0.56) | SIGMAR1OPRM1KCNH2DRD2LTA4H | |
| SCHEMBL11224270 | 0.81 | SIGMAR1 (0.58) | SIGMAR1OPRM1DRD2LTA4H | |
| SCHEMBL11234750 | 0.77 | DRD2 (0.44) | OPRM1DRD2 | |
| SCHEMBL11284561 | 0.77 | SIGMAR1 (1.00) | SIGMAR1OPRM1KCNH2 | |
| SCHEMBL17317312 | 0.77 | SIGMAR1 (1.00) | SIGMAR1OPRM1KCNH2 | |
| SCHEMBL11235328 | 0.77 | SIGMAR1 (0.45) | SIGMAR1OPRM1KCNH2DRD2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4353901-A | HYPERTENSION, CONGESTIVE HEART FAILURE, ARRHYTHMIAMIGRAINE, VASOSPASTIC DISORDERS, ASTHMA | SYNTEX (U.S.A.) INC. (US) | 1982-10-12 | — | — | US | disclosed |