Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 20/20 | 0.43 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30454803 | 0.83 | GRIN2B (0.40) | GRIN2B | |
| SCHEMBL13842796 | 0.73 | KDM4E (0.67) | GRIN2BGRIN1 | |
| SCHEMBL10044956 | 0.71 | ALPI (0.50) | — | |
| SCHEMBL15329750 | 0.69 | — | — | |
| SCHEMBL17369088 | 0.68 | ALPL (0.50) | GRIN2BGRIN1 | |
| SCHEMBL15331630 | 0.67 | PDE4A (0.31) | — | |
| SCHEMBL2346346 | 0.67 | ADORA2B (0.41) | — | |
| SCHEMBL13341568 | 0.66 | MAPT (0.33) | — | |
| SCHEMBL24802449 | 0.66 | GRIN2B (0.48) | GRIN2BGRIN1CYP2C9 | |
| SCHEMBL11160441 | 0.65 | ALDH1A1 (0.47) | — |
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-2022268209-A1 | DERIVATIVE HAVING PYRIMIDINE-FUSED CYCLIC STRUCTURE, AND USE THEREOF | 四川汇宇制药股份有限公司 | 2022-12-29 | — | — | WO | disclosed |