Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 14/20 | 0.61 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.58 |
| ▸ | MAOB | P27338 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | HRH2 | P25021 | 2/20 | 0.51 |
| ▸ | HRH1 | P35367 | 2/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL3580433 | 0.91 | HRH3 (0.66) | HRH3KCNH2MAOBMAPTALDH1A1 | |
| SCHEMBL6472573 | 0.80 | HRH3 (0.72) | HRH3KCNH2MAPTALDH1A1GAA | |
| SCHEMBL3586173 | 0.79 | HRH3 (0.71) | HRH3KCNH2MAOBMAPTALDH1A1 | |
| Hydrochloric Acid SCHEMBL3581152 | 0.78 | HRH3 (0.69) | HRH3KCNH2MAPTALDH1A1GAA | |
| SCHEMBL3581520 | 0.78 | HRH3 (0.62) | HRH3KCNH2MAOBMAPTALDH1A1 | |
| SCHEMBL21659403 | 0.78 | HRH3 (0.68) | HRH3KCNH2MAOBMAPTALDH1A1 | |
| SCHEMBL3585244 | 0.77 | HRH3 (0.71) | HRH3KCNH2MAPTALDH1A1GAA | |
| Hydrochloric Acid SCHEMBL5935422 | 0.77 | HRH3 (0.67) | HRH3MAOBHRH2HRH1 | |
| Hydrochloric Acid SCHEMBL5935373 | 0.77 | HRH3 (0.67) | HRH3MAOBHRH2HRH1 | |
| SCHEMBL14006880 | 0.76 | HRH3 (0.98) | HRH3KCNH2HRH1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3057963-B1 | PIPERAZINE DERIVATIVES AND THE USE THEREOF AS MEDICAMENT | BOEHRINGER INGELHEIM INT (DE) | 2019-06-19 | — | — | EP | disclosed |