Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | DRD1 | P21728 | 1/20 | 0.32 |
| ▸ | EDNRA | P25101 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9739283 | 0.85 | HRH3 (0.41) | HRH3 | |
| Hydrochloric Acid SCHEMBL9739083 | 0.84 | HRH3 (0.40) | HRH3 | |
| SCHEMBL9740494 | 0.81 | SMN1; SMN2 (0.39) | MAOAMAOBHRH3KCNH2 | |
| SCHEMBL9739398 | 0.81 | MAOA (0.36) | MAOAMAOBDRD2HRH3KCNH2 | |
| SCHEMBL9740102 | 0.77 | KCNH2 (0.41) | CYP2D6HRH3KCNH2 | |
| SCHEMBL9740238 | 0.76 | ABCB1 (0.42) | HRH3 | |
| Hydrochloric Acid SCHEMBL9740197 | 0.76 | CYP3A4 (0.42) | HRH3 | |
| SCHEMBL9740267 | 0.75 | HRH3 (0.44) | HRH3KCNH2 | |
| Hydrochloric Acid SCHEMBL9739389 | 0.75 | HRH3 (0.43) | HRH3KCNH2 | |
| SCHEMBL9740418 | 0.74 | ABCB1 (0.46) | HRH3 |
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 |
|---|---|---|---|---|---|---|---|
| US-5175157-A | Cardiovascular disorders | BOEHRINGER INGELHEIM GMBH (DE) | 1992-12-29 | — | — | US | disclosed |