Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 4/20 | 0.49 |
| ▸ | RORC | P51449 | 2/20 | 0.45 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.45 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.43 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.43 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.40 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.40 |
| ▸ | NPFFR2 | Q9Y5X5 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7068916 | 0.82 | CHEK2 (0.50) | PDK2CHEK2MAPK11MAPK14MEN1 | |
| SCHEMBL449719 | 0.81 | MKNK1 (0.43) | PDK2RORCGPBAR1CHEK2AKR1C3 | |
| SCHEMBL403135 | 0.80 | AKR1C3 (0.55) | PDK2CHEK2FFAR2AKR1C3AKR1C2 | |
| SCHEMBL31144967 | 0.79 | NPFFR2 (0.58) | CHEK2PARP1NPFFR2 | |
| SCHEMBL1086197 | 0.79 | NPFFR2 (0.58) | CHEK2PARP1NPFFR2 | |
| SCHEMBL27656527 | 0.78 | AR (0.51) | PDK2RORCMAPK14AKR1C3AKR1C2 | |
| Hydrochloric Acid SCHEMBL30536926 | 0.78 | NPFFR2 (0.56) | CHEK2PARP1NPFFR2 | |
| Hydrochloric Acid SCHEMBL4383135 | 0.78 | NPFFR2 (0.56) | CHEK2PARP1NPFFR2 | |
| SCHEMBL2709797 | 0.77 | AR (0.45) | PDK2CHEK2MAOBPARP1 | |
| SCHEMBL4294249 | 0.76 | HSD11B1 (0.45) | CHEK2MAOBPARP1NPFFR2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1673343-A4 | COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS | IRM LLC (BM) | 2008-09-10 | — | — | EP | disclosed |
| EP-1673343-A2 | COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS | IRM LLC (BM) | 2006-06-28 | — | — | EP | disclosed |
| WO-2005034869-A2 | COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS | IRM LLC (BM) | 2005-04-21 | — | — | WO | disclosed |