Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCL6 | P41182 | 2/20 | 0.43 |
| ▸ | AURKA | O14965 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | STK17A | Q9UEE5 | 2/20 | 0.38 |
| ▸ | MAP3K14 | Q99558 | 2/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.37 |
| ▸ | AHR | P35869 | 1/20 | 0.37 |
| ▸ | STK17B | O94768 | 1/20 | 0.37 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.37 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | PDE4A | P27815 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL21121004 | 1.00 | BCL6 (0.43) | BCL6AURKAKMT2AMEN1STK17A | |
| SCHEMBL13166258 | 0.83 | AURKA (0.50) | BCL6AURKAKMT2AMEN1STK17A | |
| SCHEMBL29809026 | 0.82 | KCNH2 (0.45) | BCL6KMT2AMEN1MAP3K14CDK2 | |
| SCHEMBL21121005 | 0.82 | KCNH2 (0.45) | BCL6KMT2AMEN1MAP3K14CDK2 | |
| SCHEMBL28953532 | 0.80 | AURKA (0.47) | BCL6AURKASTK17ASTK17BCDK2 | |
| SCHEMBL29808776 | 0.80 | AURKA (0.47) | BCL6AURKASTK17ASTK17BCDK2 | |
| SCHEMBL21163903 | 0.80 | SYK (0.52) | AURKASTK17ASTK17BCDK2KDR | |
| SCHEMBL29808778 | 0.80 | SYK (0.52) | AURKASTK17ASTK17BCDK2KDR | |
| SCHEMBL21121006 | 0.79 | BCL6 (0.48) | BCL6ADORA1CCNA2CDK2HTT | |
| SCHEMBL12277575 | 0.78 | AURKA (0.51) | AURKAKMT2AMEN1STK17ASTK17B |
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-111065635-B | Novel pyrimidine derivatives as MTH1 inhibitors | 无锡安万生物科技有限公司 | 2022-07-22 | — | — | CN | disclosed |