Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 14/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 14/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | MAT2A | P31153 | 1/20 | 0.32 |
| ▸ | XDH | P47989 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19258476 | 0.84 | GRIN1 (0.33) | GRIN1GRIN2B | |
| SCHEMBL19250590 | 0.82 | GRIN1 (0.34) | GRIN1GRIN2B | |
| SCHEMBL19258556 | 0.79 | MAP3K14 (0.30) | — | |
| SCHEMBL19259012 | 0.74 | MEN1 (0.32) | GRIN2B | |
| SCHEMBL19258499 | 0.71 | PDE10A (0.34) | — | |
| SCHEMBL19259135 | 0.69 | RPS6KA5 (0.37) | GRIN2B | |
| SCHEMBL19258987 | 0.65 | GRIN1 (0.35) | GRIN1GRIN2BCYP11B2 | |
| SCHEMBL119201 | 0.63 | ALDH1A1 (0.43) | CYP11B2CYP11B1ALDH1A1 | |
| Bromide SCHEMBL6033070 | 0.62 | ALDH1A1 (0.42) | CYP11B2CYP11B1ALDH1A1 | |
| SCHEMBL19258966 | 0.61 | ALDH1A1 (0.35) | GRIN1GRIN2BALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017133657-A1 | PYRIDINE AND PYRIMIDINE DERIVATIVES AND THEIR USE IN TREATMENT, AMELIORATION OR PREVENTION OF INFLUENZA | SAVIRA PHARMACEUTICALS GMBH (AT) | 2017-08-10 | — | — | WO | disclosed |