Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 8/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.49 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.49 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.49 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.49 |
| ▸ | HTR1A | P08908 | 1/20 | 0.49 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.49 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.49 |
| ▸ | DRD1 | P21728 | 1/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.49 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.49 |
| ▸ | DRD3 | P35462 | 1/20 | 0.49 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.45 |
| ▸ | BCHE | P06276 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8084439 | 0.78 | AOC3 (0.39) | SIGMAR1AOC3 | |
| SCHEMBL11135639 | 0.75 | SIGMAR1 (0.54) | SIGMAR1SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL14424026 | 0.71 | SIGMAR1 (0.71) | SIGMAR1SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL8091279 | 0.70 | SIGMAR1 (0.50) | SIGMAR1KCNH2 | |
| SCHEMBL11643972 | 0.69 | SIGMAR1 (0.64) | SIGMAR1SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL12540441 | 0.69 | OPRM1 (0.74) | SLC6A2SLC6A4SLC6A3KCNH2CHRM2 | |
| SCHEMBL10991198 | 0.69 | KCNH2 (0.43) | SIGMAR1KCNH2OPRM1DRD3 | |
| SCHEMBL988251 | 0.69 | KCNH2 (0.43) | SIGMAR1KCNH2OPRM1DRD3 | |
| SCHEMBL8091031 | 0.69 | SIGMAR1 (0.62) | SIGMAR1SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL9373860 | 0.69 | SIGMAR1 (0.52) | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6057371-A | TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS, GASTROINTESTINAL DISORDERS, DRUG ABUSE, ANGINA, MIGRAINE, HYPERTENSION AND DEPRESSION | VIRGINIA COMMONWEALTH UNIVERSITY (US) | 2000-05-02 | — | — | US | claimed |
| EP-0591426-A1 | SIGMA RECEPTOR LIGANDS AND THE USE THEREOF | VIRGINIA COMMONWEALTH UNIVERSITY (US) | 1994-04-13 | — | — | EP | claimed |
| WO-1993000313-A2 | SIGMA RECEPTOR LIGANDS AND THE USE THEREOF | VIRGINIA COMMONWEALTH UNIVERSITY (US) | 1993-01-07 | — | — | WO | claimed |