Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM7 | Q14831 | 2/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.50 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.50 |
| ▸ | GRIN2B | Q13224 | 4/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | PRMT5 | O14744 | 6/20 | 0.45 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.44 |
| ▸ | NPY1R | P25929 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5203096 | 0.83 | GRIN2B (0.52) | GRM7GRIN2BSIGMAR1PRMT5NPY1R | |
| SCHEMBL12656184 | 0.79 | KDM4E (0.59) | AOC3GRIN2BPRMT5NPY1R | |
| SCHEMBL9520772 | 0.73 | MAOA (0.56) | TAAR1AOC3 | |
| SCHEMBL23095755 | 0.72 | NPY1R (0.56) | PRMT5NPY1R | |
| Benzene SCHEMBL27334501 | 0.72 | GRIN2B (0.56) | GRM7GRIN2BSIGMAR1 | |
| Hydrochloric Acid SCHEMBL10446693 | 0.71 | GAA (0.62) | GRM7TAAR1GRIN2B | |
| SCHEMBL4859978 | 0.71 | GRIN2B (0.55) | GRIN2BSIGMAR1 | |
| Hydrochloric Acid SCHEMBL10447048 | 0.71 | GRM7 (0.45) | GRM7TAAR1GRIN2BSIGMAR1 | |
| SCHEMBL6252829 | 0.71 | KMT2A (0.51) | TAAR1 | |
| SCHEMBL11046082 | 0.71 | TAAR1 (0.68) | TAAR1AOC3RIPK1 |
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 |