Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 16/20 | 0.48 |
| ▸ | GRIN1 | Q05586 | 5/20 | 0.48 |
| ▸ | SOS1 | Q07889 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL24625511 | 0.89 | GRIN2B (0.39) | GRIN2BGRIN1SOS1CYP2C9 | |
| SCHEMBL24803269 | 0.82 | GRIN2B (0.42) | GRIN2BGRIN1CYP2C9 | |
| SCHEMBL4591705 | 0.81 | KDM4E (0.56) | SOS1 | |
| SCHEMBL6165302 | 0.81 | GRIN2B (0.44) | GRIN2BGRIN1SOS1CYP2C9 | |
| SCHEMBL24804775 | 0.80 | SOS1 (0.42) | GRIN2BGRIN1SOS1 | |
| SCHEMBL23520539 | 0.79 | KDM4E (0.39) | — | |
| SCHEMBL2828598 | 0.79 | ALDH1A1 (0.49) | — | |
| SCHEMBL9609771 | 0.77 | KAT2B (0.43) | — | |
| SCHEMBL23520542 | 0.77 | PLK1 (0.48) | — | |
| SCHEMBL20808986 | 0.76 | LMNA (0.44) | GRIN2BGRIN1SOS1 |
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 |