Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | TOP1 | P11387 | 2/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3569775 | 0.85 | MAP4K4 (0.41) | ADORA3TOP1 | |
| SCHEMBL3562521 | 0.82 | MAP4K4 (0.45) | ADORA3 | |
| SCHEMBL3559749 | 0.81 | MEN1 (0.44) | ADORA3TOP1 | |
| SCHEMBL3559328 | 0.80 | — | — | |
| SCHEMBL3557424 | 0.79 | LRRK2 (0.47) | — | |
| SCHEMBL3572426 | 0.76 | S1PR1 (0.51) | S1PR1 | |
| SCHEMBL3556591 | 0.75 | PFKFB3 (0.46) | ADORA3 | |
| SCHEMBL15298548 | 0.75 | ATM (0.57) | — | |
| SCHEMBL15298555 | 0.75 | ATM (0.57) | — | |
| SCHEMBL21031210 | 0.75 | LMNA (0.51) | — |
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-2001849-A1 | PYRIDINE AND PYRIMIDINE DERIVATIVES AS MGLUR2 ANTAGONISTS | F. Hoffmann-Roche AG (CH) | 2008-12-17 | — | — | EP | claimed |
| WO-2007110337-A1 | PYRIDINE AND PYRIMIDINE DERIVATIVES AS MGLUR2 ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2007-10-04 | — | — | WO | claimed |