Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK13 | O15264 | 4/20 | 0.39 |
| ▸ | MAPK12 | P53778 | 4/20 | 0.39 |
| ▸ | MAPK11 | Q15759 | 4/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.39 |
| ▸ | GCGR | P47871 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.34 |
| ▸ | CACNG8 | Q8WXS5 | 1/20 | 0.34 |
| ▸ | CACNG2 | Q9Y698 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 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 | |
|---|---|---|---|---|
| SCHEMBL5821416 | 0.89 | AOC3 (0.42) | ALDH1A1AOC3L3MBTL1KMT2A | |
| SCHEMBL5820968 | 0.86 | CA2 (0.38) | KMT2A | |
| SCHEMBL5821417 | 0.84 | ALDH1A1 (0.36) | MAPK13MAPK12MAPK11MAPK14GCGR | |
| SCHEMBL5817785 | 0.84 | ALDH1A1 (0.31) | ALDH1A1ESR1 | |
| SCHEMBL5821476 | 0.82 | ALDH1A1 (0.43) | ALDH1A1NPSR1RXFP1LMNAESR1 | |
| SCHEMBL5817617 | 0.81 | MAPK14 (0.36) | MAPK13MAPK12MAPK11MAPK14GCGR | |
| SCHEMBL5819664 | 0.81 | PTGS2 (0.39) | MAPK13MAPK12MAPK11MAPK14GCGR | |
| SCHEMBL5821043 | 0.80 | ESR1 (0.35) | ALDH1A1AOC3ESR1 | |
| SCHEMBL5817545 | 0.78 | TDP1 (0.36) | ALDH1A1RXFP1MEN1KMT2AESR1 | |
| SCHEMBL5821095 | 0.78 | CA9 (0.43) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006129181-A2 | PREPARATION OF 4-PYRIMIDONE DERIVATIVES FOR TREATING INFLAMMATORY DISEASES | ORCHID RESEARCH LABORATORIES LIMITED (IN) | 2006-12-07 | — | — | WO | disclosed |