Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.44 |
| ▸ | BRAF | P15056 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 2/20 | 0.42 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.42 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.42 |
| ▸ | PIM1 | P11309 | 1/20 | 0.42 |
| ▸ | FLT3 | P36888 | 1/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.42 |
| ▸ | PRKCI | P41743 | 1/20 | 0.41 |
| ▸ | TDP2 | O95551 | 2/20 | 0.40 |
| ▸ | POLQ | O75417 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.37 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.36 |
| ▸ | AKT1 | P31749 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2593124 | 0.89 | MAPKAPK2 (0.45) | MAPKAPK2BRAFGSK3BDAPK3NTRK1 | |
| SCHEMBL2591027 | 0.86 | GSK3B (0.43) | MAPKAPK2BRAFGSK3BDAPK3NTRK1 | |
| SCHEMBL14735760 | 0.84 | GSK3B (0.42) | MAPKAPK2BRAFGSK3BDAPK3NTRK1 | |
| SCHEMBL2585698 | 0.84 | GSK3B (0.42) | MAPKAPK2BRAFGSK3BDAPK3NTRK1 | |
| SCHEMBL2591435 | 0.84 | GSK3B (0.42) | MAPKAPK2BRAFGSK3BDAPK3NTRK1 | |
| SCHEMBL17599586 | 0.83 | GSK3B (0.41) | MAPKAPK2BRAFGSK3BDAPK3NTRK1 | |
| SCHEMBL17599629 | 0.83 | HSD17B1 (0.49) | ADORA1HSD17B1KDM4EALDH1A1HPGD | |
| SCHEMBL2588115 | 0.83 | PTGS2 (0.39) | MAPKAPK2GSK3BDAPK3NTRK1PIM1 | |
| SCHEMBL2581983 | 0.83 | POLQ (0.42) | MAPKAPK2BRAFGSK3BDAPK3NTRK1 | |
| SCHEMBL2589137 | 0.83 | GSK3B (0.40) | MAPKAPK2BRAFGSK3BDAPK3NTRK1 |
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-2563770-B1 | BIARYL PHOSPHODIESTERASE INHIBITORS | LEO PHARMA AS (DK) | 2016-03-23 | — | — | EP | disclosed |
| EP-2563770-A1 | BIARYL PHOSPHODIESTERASE INHIBITORS | Leo Pharma A/S (DK) | 2013-03-06 | — | — | EP | disclosed |