Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | STAT3 | P40763 | 2/20 | 0.50 |
| ▸ | STAT1 | P42224 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.50 |
| ▸ | TLR9 | Q9NR96 | 2/20 | 0.50 |
| ▸ | MITF | O75030 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | MAOA | P21397 | 1/20 | 0.49 |
| ▸ | MAOB | P27338 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | SDHB | P21912 | 2/20 | 0.43 |
| ▸ | SYK | P43405 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3567232 | 0.91 | KIF11 (0.45) | KDM4ELMNASTAT3STAT1RAB9A | |
| SCHEMBL3569106 | 0.90 | KDM4E (0.53) | KDM4EALDH1A1LMNASTAT3STAT1 | |
| SCHEMBL3568481 | 0.86 | SYK (0.47) | KDM4EALDH1A1LMNASTAT3STAT1 | |
| SCHEMBL3564767 | 0.81 | — | — | |
| SCHEMBL3568722 | 0.80 | PTGES2 (0.48) | LMNASTAT3STAT1RAB9ANPSR1 | |
| SCHEMBL3564758 | 0.80 | LRRK2 (0.43) | MAOAMAOBCA2CA9PTGS2 | |
| SCHEMBL3560858 | 0.79 | KDM4E (0.53) | KDM4EALDH1A1MAOBCA2CA9 | |
| SCHEMBL3568564 | 0.79 | KDM4E (0.47) | KDM4EALDH1A1LMNASTAT3STAT1 | |
| SCHEMBL3564023 | 0.79 | KIF11 (0.56) | PTGS2PTGS1 | |
| SCHEMBL2402375 | 0.78 | LRRK2 (0.47) | PTGS2SYKPTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2468727-A1 | Pyridine and pyrimidine derivatives as MGLUR2 antagonists | F. Hoffmann-La Roche AG (CH) | 2012-06-27 | — | — | EP | claimed |