Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGMT | P16455 | 8/20 | 0.40 |
| ▸ | DHFR | P00374 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | PTGES | O14684 | 4/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 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 | |
|---|---|---|---|---|
| SCHEMBL29974131 | 1.00 | MGMT (0.40) | MGMTDHFRMAPTLMNACCNA2 | |
| SCHEMBL28877840 | 0.83 | MAPT (0.44) | MGMTDHFRMAPTCCNA2CDK2 | |
| SCHEMBL29973964 | 0.83 | MAPT (0.44) | MGMTDHFRMAPTCCNA2CDK2 | |
| SCHEMBL28877902 | 0.81 | PIK3CA (0.34) | DHFRMTORPTGESPDE4APDE4B | |
| SCHEMBL29974305 | 0.69 | HSPB1 (0.56) | MAPTLMNAMEN1NPC1RAB9A | |
| SCHEMBL558792 | 0.69 | HSPB1 (0.56) | MAPTLMNAMEN1NPC1RAB9A | |
| SCHEMBL29974285 | 0.67 | HRH2 (0.42) | MGMTDHFRCCNA2CDK2CCNA1 | |
| SCHEMBL27612801 | 0.64 | PIK3CG (0.53) | MGMTMAPTMTORMEN1RAB9A | |
| SCHEMBL27612725 | 0.64 | CD274 (0.46) | MAPTMTORNPC1RAB9A | |
| SCHEMBL9640554 | 0.64 | MGMT (0.49) | MGMTMAPTLMNACCNA2CDK2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115141202-A | Pyrimidopyrazinone compounds and uses thereof | 武汉人福创新药物研发中心有限公司 | 2022-10-04 | — | — | CN | disclosed |