Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.37 |
| ▸ | AURKA | O14965 | 4/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | RAF1 | P04049 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 5/20 | 0.32 |
| ▸ | LMNA | P02545 | 4/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL7367477 | 0.88 | ALDH1A1 (0.42) | PTGDR2AURKACYP3A4MAPK14NPSR1 | |
| SCHEMBL7364012 | 0.84 | PTGS2 (0.35) | HTR6PTGS2NPSR1LMNAALDH1A1 | |
| SCHEMBL7373754 | 0.78 | IGF1R (0.39) | PTGDR2AURKAPTGS2EGFRRAF1 | |
| SCHEMBL5673928 | 0.77 | MAPK14 (0.40) | PTGDR2AURKACYP2C19CYP3A4HTR6 | |
| SCHEMBL5671102 | 0.72 | MAPK14 (0.50) | PTGS2EGFRRAF1ADORA3ADORA2A | |
| SCHEMBL7367472 | 0.68 | KDM4E (0.39) | AURKACYP3A4HTR6MAPK14LMNA | |
| SCHEMBL5670985 | 0.67 | ADORA2A (0.41) | PTGS2EGFRRAF1ADORA3ADORA2A | |
| SCHEMBL5673361 | 0.66 | ADORA2A (0.36) | HTR6PTGS2EGFRRAF1ADORA3 | |
| SCHEMBL7373031 | 0.66 | ADORA1 (0.48) | EGFRRAF1ADORA3ADORA2AADORA2B | |
| SCHEMBL7369957 | 0.66 | PDE3A (0.48) | EGFRRAF1ADORA3ADORA2AADORA2B |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1244669-A1 | PYRAZOLOPYRAZINES AND THEIR USE AS ADENOSINE ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2002-10-02 | — | — | EP | disclosed |
| WO-2001040230-A1 | PYRAZOLOPYRAZINES AND THEIR USE AS ADENOSINE ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2001-06-07 | — | — | WO | disclosed |