Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKB | Q96GD4 | 3/20 | 0.45 |
| ▸ | EGFR | P00533 | 2/20 | 0.45 |
| ▸ | RAF1 | P04049 | 1/20 | 0.45 |
| ▸ | KDR | P35968 | 1/20 | 0.45 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.45 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.45 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.42 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | GRM5 | P41594 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4712992 | 1.00 | AURKB (0.45) | AURKBEGFRRAF1KDRMAP2K2 | |
| SCHEMBL4713138 | 0.90 | ALDH1A1 (0.43) | AURKBEGFRRAF1KDRMAP2K2 | |
| SCHEMBL4710865 | 0.80 | MEN1 (0.50) | CYSLTR2CYSLTR1ALDH1A1HDAC6CYP3A4 | |
| SCHEMBL4710866 | 0.80 | MEN1 (0.50) | CYSLTR2CYSLTR1ALDH1A1HDAC6CYP3A4 | |
| SCHEMBL4710790 | 0.78 | MEN1 (0.51) | CYSLTR2CYSLTR1ALDH1A1HDAC6CYP3A4 | |
| SCHEMBL4710791 | 0.78 | MEN1 (0.51) | CYSLTR2CYSLTR1ALDH1A1HDAC6CYP3A4 | |
| SCHEMBL4712894 | 0.78 | HDAC8 (0.50) | HDAC6NPSR1HDAC3HDAC1HDAC2 | |
| SCHEMBL4712896 | 0.78 | HDAC8 (0.50) | HDAC6NPSR1HDAC3HDAC1HDAC2 | |
| SCHEMBL4715210 | 0.78 | KMT2A (0.51) | CYSLTR2CYSLTR1ALDH1A1HDAC6CYP3A4 | |
| SCHEMBL4715212 | 0.78 | KMT2A (0.51) | CYSLTR2CYSLTR1ALDH1A1HDAC6CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0998459-B1 | PYRIDINE DERIVATIVES | NOVARTIS AG (CH) | 2008-04-23 | — | — | EP | claimed |
| EP-0998459-B1 | PYRIDINE DERIVATIVES | NOVARTIS AG (CH) | 2008-04-23 | — | — | EP | disclosed |