Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 4/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.36 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.34 |
| ▸ | PDE1C | Q14123 | 2/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.33 |
| ▸ | CACNA1C | Q13936 | 2/20 | 0.33 |
| ▸ | PDE2A | O00408 | 1/20 | 0.33 |
| ▸ | PDE5A | O76074 | 1/20 | 0.33 |
| ▸ | PDE1A | P54750 | 1/20 | 0.33 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7282249 | 0.89 | CYP2C9 (0.43) | CYP2C9CYP2C19CYP3A4CYP1A2TSHR | |
| SCHEMBL7278351 | 0.86 | CYP2C9 (0.41) | CYP2C9CYP2C19CYP3A4CYP1A2TSHR | |
| SCHEMBL7278440 | 0.82 | ALDH1A1 (0.42) | CYP2C9CYP2C19CYP3A4CYP1A2HSD17B10 | |
| SCHEMBL7271467 | 0.76 | KDM4E (0.41) | CYP2C9CYP2C19CYP3A4CYP1A2TSHR | |
| SCHEMBL7271051 | 0.74 | ACHE (0.53) | CYP2C9CYP2C19CYP3A4CYP1A2TSHR | |
| SCHEMBL7271711 | 0.74 | ALDH1A1 (0.32) | CYP2C9CYP2C19CYP3A4PDE1CPDE4D | |
| SCHEMBL7273349 | 0.74 | LMNA (0.43) | CYP2C9CYP2C19CYP3A4CYP1A2HSD17B10 | |
| SCHEMBL7279903 | 0.73 | CACNA1C (0.44) | CYP2C9CYP2C19CYP3A4CYP1A2TSHR | |
| SCHEMBL7282256 | 0.72 | ADORA3 (0.62) | CYP2C9CYP2C19CYP3A4CYP1A2TSHR | |
| SCHEMBL7272890 | 0.72 | LMNA (0.51) | CYP2C9CYP2C19CYP3A4CYP1A2TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0114273-B1 | NEW PHARMACOLOGICALLY ACTIVE PYRAZOLOPYRIDINES | GRUPPO LEPETIT S.p.A. (IT) | 1991-11-06 | — | — | EP | disclosed |
| US-4954508-A | HYPOTENSIVE | GRUPPO LEPETIT S.P.A. (IT) | 1990-09-04 | — | — | US | disclosed |
| EP-0114273-A1 | New pharmacologically active pyrazolopyridines | GRUPPO LEPETIT S.p.A. (IT) | 1984-08-01 | — | — | EP | disclosed |