Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APEX1 | P27695 | 1/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | CD38 | P28907 | 1/20 | 0.37 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.35 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.35 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | PDE5A | O76074 | 1/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.35 |
| ▸ | METAP2 | P50579 | 1/20 | 0.35 |
| ▸ | VNN1 | O95497 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17757561 | 0.91 | CD38 (0.44) | HDAC3HDAC1HDAC2HDAC6CD38 | |
| SCHEMBL17757569 | 0.90 | APEX1 (0.38) | APEX1HCAR2HDAC3HDAC1HDAC2 | |
| SCHEMBL17757560 | 0.89 | CD38 (0.36) | APEX1HDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL17757566 | 0.86 | P2RX7 (0.36) | HDAC3HDAC1HDAC2HDAC6MEN1 | |
| SCHEMBL17757559 | 0.84 | LMNA (0.40) | HDAC3HDAC1HDAC2HDAC6CD38 | |
| SCHEMBL17757567 | 0.84 | HDAC3 (0.35) | HDAC3HDAC1HDAC2HDAC6MEN1 | |
| SCHEMBL17757552 | 0.84 | FABP4 (0.35) | MEN1KMT2A | |
| SCHEMBL17757608 | 0.83 | CD38 (0.45) | HDAC3HDAC1HDAC2HDAC6CD38 | |
| SCHEMBL17757777 | 0.82 | CD38 (0.44) | HDAC3HDAC1HDAC2HDAC6CD38 | |
| SCHEMBL17758049 | 0.82 | ACAT2 (0.43) | PDE5AMEN1KMT2ALMNA |
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-116589479-B | Quinoxaline derivative with antifungal activity and application thereof | 中国人民解放军海军军医大学 | 2024-11-22 | — | — | CN | disclosed |