Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | PDE2A | O00408 | 2/20 | 0.34 |
| ▸ | PDE1A | P54750 | 1/20 | 0.34 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.34 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | APAF1 | O14727 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3930634 | 0.83 | MAPK1 (0.55) | MAPK1HSD17B10ALDH1A1GAACYP2C9 | |
| SCHEMBL13960689 | 0.82 | MAPK1 (0.37) | MAPK1HSD17B10GAACYP1A2CYP3A4 | |
| SCHEMBL7132364 | 0.80 | MAPK1 (0.60) | MAPK1HSD17B10ALDH1A1ADORA2AADORA2B | |
| SCHEMBL3929186 | 0.80 | MAPK1 (0.44) | MAPK1HSD17B10ALDH1A1THRBRXFP1 | |
| SCHEMBL3918621 | 0.79 | MAPK1 (0.44) | MAPK1HSD17B10ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL3921269 | 0.77 | MAPK1 (0.40) | MAPK1HSD17B10ALDH1A1CYP2C9THRB | |
| SCHEMBL7066378 | 0.76 | MAPK1 (0.64) | MAPK1HSD17B10ALDH1A1ADORA2AADORA2B | |
| SCHEMBL7128338 | 0.76 | MAPK1 (0.56) | MAPK1HSD17B10ALDH1A1ADORA2AADORA2B | |
| SCHEMBL7067237 | 0.74 | MAPK1 (0.54) | MAPK1HSD17B10ALDH1A1ADORA2AADORA2B | |
| SCHEMBL7067024 | 0.74 | MAPK1 (0.54) | MAPK1HSD17B10ALDH1A1ADORA2AADORA2B |
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 |
|---|---|---|---|---|---|---|---|
| US-7479489-B2 | Heterocyclic antiviral compounds | ROCHE PALO ALTO LLC (US) | 2009-01-20 | — | — | US | disclosed |