Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 6/20 | 0.59 |
| ▸ | HTR3E | A5X5Y0 | 4/20 | 0.59 |
| ▸ | HTR3B | O95264 | 4/20 | 0.59 |
| ▸ | HTR3D | Q70Z44 | 4/20 | 0.59 |
| ▸ | HTR3C | Q8WXA8 | 4/20 | 0.59 |
| ▸ | HRH4 | Q9H3N8 | 7/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | THPO | P40225 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL12186828 | 0.82 | CYP1A2 (0.42) | HTR3AHTR3EHTR3BHTR3DHTR3C | |
| SCHEMBL419964 | 0.81 | HTR3A (0.47) | HTR3AHTR3EHTR3BHTR3DHTR3C | |
| SCHEMBL2401439 | 0.79 | HTR3A (0.58) | HTR3AHTR3EHTR3BHTR3DHTR3C | |
| SCHEMBL2640550 | 0.78 | HRH4 (0.54) | HTR3AHRH4HRH3 | |
| SCHEMBL19582126 | 0.78 | HTR3A (0.47) | HTR3AHTR3EHTR3BHTR3DHTR3C | |
| SCHEMBL3056725 | 0.78 | KDM4E (0.64) | HTR3AHTR3EHTR3BHTR3DHTR3C | |
| SCHEMBL12186838 | 0.78 | KMT2A (0.41) | KDM4EALDH1A1CYP1A2 | |
| SCHEMBL13039373 | 0.78 | HTR2C (0.64) | HTR3AHTR3EHTR3BHTR3DHTR3C | |
| Hydrochloric Acid SCHEMBL11557145 | 0.76 | KDM4E (0.62) | HTR3AHTR3EHTR3BHTR3DHTR3C | |
| SCHEMBL13771998 | 0.76 | HRH4 (0.46) | HTR3AHTR3EHTR3BHTR3DHTR3C |
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-2318408-B1 | TRI-CYCLIC PYRAZOLOPYRIDINE KINASE INHIBITORS | VERTEX PHARMA (US) | 2016-02-17 | — | — | EP | disclosed |