Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 20/20 | 0.97 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.97 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.97 |
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 | |
|---|---|---|---|---|
| SCHEMBL4184191 | 0.90 | HRH3 (0.84) | HRH3CYP2D6CYP3A4 | |
| SCHEMBL4027407 | 0.89 | HRH3 (0.97) | HRH3CYP2D6CYP3A4 | |
| SCHEMBL4184915 | 0.88 | HRH3 (1.00) | HRH3CYP2D6CYP3A4 | |
| SCHEMBL4028586 | 0.87 | HRH3 (0.97) | HRH3CYP2D6CYP3A4 | |
| SCHEMBL4188312 | 0.86 | HRH3 (1.00) | HRH3CYP2D6CYP3A4 | |
| SCHEMBL4020966 | 0.86 | HRH3 (1.00) | HRH3CYP2D6 | |
| SCHEMBL4184767 | 0.85 | HRH3 (1.00) | HRH3 | |
| SCHEMBL4025332 | 0.84 | HRH3 (0.89) | HRH3CYP2D6CYP3A4 | |
| SCHEMBL4020046 | 0.84 | HRH3 (1.00) | HRH3CYP2D6 | |
| SCHEMBL4018779 | 0.84 | HRH3 (0.85) | HRH3CYP2D6CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009095394-A1 | DIAZEPANES AS HISTAMINE H3 RECEPTOR ANTAGONISTS | EVOTEC NEUROSCIENCES GMBH (DE) | 2009-08-06 | — | — | WO | disclosed |
| WO-2009095394-A1 | DIAZEPANES AS HISTAMINE H3 RECEPTOR ANTAGONISTS | EVOTEC NEUROSCIENCES GMBH (DE) | 2009-08-06 | — | — | WO | disclosed |