Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | XDH | P47989 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | GRM1 | Q13255 | 2/20 | 0.38 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL30716457 | 0.85 | GAA (0.51) | XDHMEN1KMT2APOLBMAPK1 | |
| SCHEMBL30716453 | 0.85 | ALDH1A1 (0.40) | RAB9AALDH1A1ALOX15CYP1A2CYP3A4 | |
| SCHEMBL27761998 | 0.85 | LMNA (0.40) | KMT2AGRM1GAALMNATP53 | |
| SCHEMBL30716458 | 0.85 | XDH (0.41) | RAB9AXDHALDH1A1MEN1KMT2A | |
| SCHEMBL30716452 | 0.84 | FGFR1 (0.44) | RAB9AXDHALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL30716465 | 0.84 | SMN1; SMN2 (0.46) | XDHALDH1A1HTTPOLBMAPT | |
| SCHEMBL30716464 | 0.82 | KMT2A (0.42) | ALDH1A1ATMKMT2AGRM1 | |
| SCHEMBL30716463 | 0.81 | ALDH1A1 (0.50) | XDHALDH1A1ALOX15CYP1A2CYP3A4 | |
| SCHEMBL30716459 | 0.81 | POLB (0.45) | ALDH1A1HTTPOLBMAPTLMNA | |
| SCHEMBL30716454 | 0.76 | RXFP1 (0.50) | CYP1A2POLBMAPTMAPK1GAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117343046-A | Novel 3-oxo-4-substituted aryl-3, 4-dihydropyrazine-2-carboxamide compound and application thereof | 辽宁大学 | 2024-01-05 | — | — | CN | claimed |
| CN-117343046-A | Novel 3-oxo-4-substituted aryl-3, 4-dihydropyrazine-2-carboxamide compound and application thereof | 辽宁大学 | 2024-01-05 | — | — | CN | disclosed |