Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 10/20 | 0.37 |
| ▸ | HTR7 | P34969 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8971073 | 0.89 | SIGMAR1 (0.46) | SIGMAR1HRH3HTR7 | |
| SCHEMBL2560103 | 0.87 | CARM1 (0.38) | SIGMAR1HRH3 | |
| SCHEMBL31124137 | 0.87 | CARM1 (0.38) | SIGMAR1HRH3 | |
| SCHEMBL5808106 | 0.83 | SIGMAR1 (0.50) | SIGMAR1HRH3 | |
| SCHEMBL15760641 | 0.82 | SIGMAR1 (0.49) | SIGMAR1HRH3 | |
| SCHEMBL9689464 | 0.81 | HTR7 (0.41) | SIGMAR1HRH3HTR7 | |
| SCHEMBL9374563 | 0.80 | SIGMAR1 (0.46) | SIGMAR1HRH3 | |
| SCHEMBL2115304 | 0.77 | SIGMAR1 (0.41) | SIGMAR1HRH3HTR7 | |
| SCHEMBL14197717 | 0.77 | GNAO1 (0.53) | SIGMAR1 | |
| SCHEMBL10130234 | 0.77 | GNAO1 (0.53) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013177510-A1 | NEURONAL NICOTINIC RECEPTOR AGONISTS FOR TREATING SCHIZOPHRENIA IN PATIENTS WITH VARIANTS OF COMT GENE | ABBVIE INC. (US) | 2013-11-28 | — | — | WO | disclosed |