Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 5/20 | 0.59 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.56 |
| ▸ | CDK2 | P24941 | 2/20 | 0.56 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.56 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.56 |
| ▸ | APP | P05067 | 6/20 | 0.51 |
| ▸ | MAPT | P10636 | 6/20 | 0.51 |
| ▸ | GAA | P10253 | 5/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.51 |
| ▸ | GLA | P06280 | 4/20 | 0.51 |
| ▸ | NPC1 | O15118 | 4/20 | 0.51 |
| ▸ | RAB9A | P51151 | 4/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | CA5A | P35218 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | HPGD | P15428 | 5/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.49 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
| ▸ | MMP9 | P14780 | 1/20 | 0.47 |
| ▸ | MMP8 | P22894 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL31591976 | 0.85 | CCNE1 (0.51) | RORCCCNE1CDK2CDK5CDK5R1 | |
| SCHEMBL10311768 | 0.83 | RORC (0.71) | RORCCCNE1CDK2CDK5CDK5R1 | |
| SCHEMBL2628245 | 0.81 | RORC (0.68) | RORCCCNE1CDK2CDK5CDK5R1 | |
| SCHEMBL31591998 | 0.80 | RORC (0.62) | RORCCCNE1CDK2CDK5CDK5R1 | |
| SCHEMBL31592007 | 0.79 | CCNE1 (0.51) | RORCCCNE1CDK2CDK5CDK5R1 | |
| SCHEMBL31592010 | 0.78 | RORC (0.62) | RORCCCNE1CDK2CDK5CDK5R1 | |
| SCHEMBL1983033 | 0.77 | RORC (0.63) | RORCCCNE1CDK2CDK5CDK5R1 | |
| SCHEMBL1983034 | 0.77 | RORC (0.63) | RORCCCNE1CDK2CDK5CDK5R1 | |
| SCHEMBL31592018 | 0.77 | RORC (0.53) | RORCCCNE1CDK2CDK5CDK5R1 | |
| SCHEMBL25308120 | 0.76 | MAPT (0.82) | RORCAPPMAPTGAAKDM4E |
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-113912563-B | Benzo five-membered nitrogen heterocyclic compound and application thereof | 中国科学院广州生物医药与健康研究院 | 2025-05-27 | — | — | CN | disclosed |