Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9014958 | 0.95 | CYP1A2 (0.31) | CYP1A2CYP3A4HRH3 | |
| SCHEMBL9014769 | 0.93 | CYP1A2 (0.30) | CYP1A2CYP3A4 | |
| SCHEMBL9014694 | 0.83 | LOX (0.35) | CYP1A2CYP3A4 | |
| SCHEMBL9014905 | 0.82 | THRB (0.35) | — | |
| SCHEMBL9014791 | 0.78 | KDM4E (0.44) | — | |
| SCHEMBL9014882 | 0.76 | KDM4E (0.33) | — | |
| SCHEMBL9014894 | 0.72 | DRD2 (0.52) | CYP1A2CYP3A4HRH3 | |
| SCHEMBL9014893 | 0.71 | HRH3 (0.50) | CYP1A2CYP3A4HRH3 | |
| SCHEMBL9014904 | 0.70 | HRH3 (0.49) | CYP1A2CYP3A4HRH3 | |
| SCHEMBL9014695 | 0.70 | SLC6A2 (0.45) | CYP1A2CYP3A4HRH3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5578596-A | TREATMENT OF SEROTONERGIC NEURON RELATED DISEASES, MOTION SICKNESS, ANXIXETY, DEPRESSION | ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) | 1996-11-26 | — | — | US | disclosed |
| EP-0668276-A1 | 2-ALKOXY-5,6,7,8-TETRAHYDROQUINOXALINE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 1995-08-23 | — | — | EP | disclosed |