Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH2 | P25021 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.40 |
| ▸ | MGMT | P16455 | 7/20 | 0.39 |
| ▸ | DHFR | P00374 | 1/20 | 0.35 |
| ▸ | DGAT1 | O75907 | 6/20 | 0.34 |
| ▸ | SOAT1 | P35610 | 4/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | GSK3A | P49840 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.34 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29973630 | 0.77 | DHFR (0.40) | HRH2HRH3DHFRDGAT1SOAT1 | |
| SCHEMBL28877840 | 0.73 | MAPT (0.44) | CCNA2CDK2CCNA1MGMTDHFR | |
| SCHEMBL29973964 | 0.73 | MAPT (0.44) | CCNA2CDK2CCNA1MGMTDHFR | |
| SCHEMBL29974026 | 0.72 | CCNA2 (0.48) | HRH2HRH3CCNA2CDK2CCNA1 | |
| SCHEMBL28877937 | 0.72 | CCNA2 (0.48) | HRH2HRH3CCNA2CDK2CCNA1 | |
| SCHEMBL27612725 | 0.72 | CD274 (0.46) | — | |
| SCHEMBL27612801 | 0.69 | PIK3CG (0.53) | HRH3MGMTMEN1KMT2A | |
| SCHEMBL9640554 | 0.69 | MGMT (0.49) | CCNA2CDK2CCNA1MGMTKMT2A | |
| SCHEMBL27939440 | 0.68 | CYP2A6 (0.42) | MGMTDHFRMEN1KMT2A | |
| SCHEMBL29974131 | 0.67 | MGMT (0.40) | CCNA2CDK2CCNA1MGMTDHFR |
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 |