Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 8/20 | 0.68 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.56 |
| ▸ | DRD2 | P14416 | 1/20 | 0.53 |
| ▸ | DRD4 | P21917 | 1/20 | 0.53 |
| ▸ | DRD3 | P35462 | 1/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL13569139 | 0.87 | TAAR1 (0.61) | SIGMAR1TAAR1 | |
| SCHEMBL5139428 | 0.87 | TAAR1 (0.61) | SIGMAR1TAAR1 | |
| SCHEMBL30444743 | 0.85 | TAAR1 (0.59) | SIGMAR1TAAR1 | |
| SCHEMBL16203114 | 0.85 | TAAR1 (0.59) | SIGMAR1TAAR1 | |
| SCHEMBL28585404 | 0.85 | TAAR1 (0.59) | SIGMAR1TAAR1 | |
| SCHEMBL8100045 | 0.83 | SIGMAR1 (0.76) | SIGMAR1DRD2DRD4DRD3KCNH2 | |
| SCHEMBL9660784 | 0.82 | TAAR1 (0.65) | SIGMAR1TAAR1KCNH2 | |
| SCHEMBL4254894 | 0.82 | SIGMAR1 (1.00) | SIGMAR1DRD2DRD4DRD3KCNH2 | |
| SCHEMBL2538905 | 0.80 | SIGMAR1 (0.95) | SIGMAR1DRD2DRD4DRD3KCNH2 | |
| SCHEMBL5240585 | 0.80 | TAAR1 (0.68) | SIGMAR1TAAR1 |
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 4 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 | disclosed |
| EP-0591426-A1 | SIGMA RECEPTOR LIGANDS AND THE USE THEREOF | VIRGINIA COMMONWEALTH UNIVERSITY (US) | 1994-04-13 | — | — | EP | disclosed |
| WO-1993000313-A2 | SIGMA RECEPTOR LIGANDS AND THE USE THEREOF | VIRGINIA COMMONWEALTH UNIVERSITY (US) | 1993-01-07 | — | — | WO | disclosed |
| WO-1991009594-A1 | SIGMA RECEPTOR LIGANDS AND THE USE THEREOF | VIRGINIA COMMONWEALTH UNIVERSITY (US) | 1991-07-11 | — | — | WO | disclosed |