Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | FGFR1 | P11362 | 3/20 | 0.44 |
| ▸ | AKT1 | P31749 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | CCR3 | P51677 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14223274 | 0.81 | HTT (0.57) | HTTFGFR1HRH3ALDH1A1 | |
| SCHEMBL19567982 | 0.80 | HTT (0.45) | HTTFGFR1AKT1HRH3 | |
| SCHEMBL19567557 | 0.78 | HTT (0.43) | HTTFGFR1AKT1HRH3 | |
| SCHEMBL4942172 | 0.78 | MKNK1 (0.50) | HTTFGFR1ALDH1A1 | |
| SCHEMBL2407205 | 0.76 | CCR3 (0.65) | HTTACHECCR3HRH3ALDH1A1 | |
| SCHEMBL20781989 | 0.76 | HTT (0.40) | HTTFGFR1AKT1HRH3 | |
| SCHEMBL1816405 | 0.76 | HRH3 (0.53) | HTTFGFR1HRH3 | |
| SCHEMBL24093260 | 0.75 | HTT (0.47) | HTTFGFR1 | |
| Hydrochloric Acid SCHEMBL1816217 | 0.75 | HRH3 (0.52) | HTTFGFR1HRH3 | |
| SCHEMBL1814415 | 0.75 | HRH3 (0.52) | HTTFGFR1HRH3 |
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-3452464-B1 | PYRAZOLE DERIVATIVES, COMPOSITIONS AND THERAPEUTIC USE THEREOF | HOFFMANN LA ROCHE (CH) | 2021-12-15 | — | — | EP | disclosed |