Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 13/20 | 0.53 |
| ▸ | HRH4 | Q9H3N8 | 5/20 | 0.53 |
| ▸ | PTAFR | P25105 | 1/20 | 0.49 |
| ▸ | DRD3 | P35462 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.39 |
| ▸ | DRD1 | P21728 | 3/20 | 0.39 |
| ▸ | HTR2A | P28223 | 3/20 | 0.39 |
| ▸ | HTR2C | P28335 | 3/20 | 0.39 |
| ▸ | HTR3A | P46098 | 3/20 | 0.39 |
| ▸ | DRD2 | P14416 | 3/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.39 |
| ▸ | CNR1 | P21554 | 2/20 | 0.39 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.39 |
| ▸ | HTR2B | P41595 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20978776 | 0.88 | HRH1 (0.47) | HRH1HRH4PTAFRDRD3LMNA | |
| SCHEMBL20381716 | 0.83 | HRH1 (0.54) | HRH1HRH4PTAFRDRD3LMNA | |
| SCHEMBL20381726 | 0.83 | HRH1 (0.54) | HRH1HRH4PTAFRDRD3LMNA | |
| SCHEMBL20978788 | 0.81 | HRH1 (0.52) | HRH1HRH4PTAFRDRD3LMNA | |
| SCHEMBL20978905 | 0.79 | HRH1 (0.54) | HRH1HRH4PTAFRDRD3LMNA | |
| SCHEMBL14473932 | 0.79 | HRH1 (0.62) | HRH1HRH4PTAFRDRD3LMNA | |
| SCHEMBL12909408 | 0.78 | HRH1 (0.72) | HRH1HRH4DRD3LMNACHRM2 | |
| SCHEMBL14474694 | 0.74 | HRH1 (0.43) | HRH1HRH4PTAFRDRD3LMNA | |
| SCHEMBL10846771 | 0.72 | HRH1 (0.57) | HRH1HRH4DRD3LMNACHRM2 | |
| SCHEMBL14474692 | 0.71 | HRH1 (0.43) | HRH1HRH4PTAFRDRD3LMNA |
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-2727919-B1 | BENZOCYCLOHEPTANETHIOPHENE DERIVATIVES FOR ANTI-ALLERGIC REACTIONS | FUJIAN MINDONG REJUVENATION PHARMACEUTICAL CO LTD (CN) | 2019-05-08 | — | — | EP | disclosed |