Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MKNK1 | Q9BUB5 | 4/20 | 0.51 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.50 |
| ▸ | TNIK | Q9UKE5 | 2/20 | 0.47 |
| ▸ | CDC7 | O00311 | 1/20 | 0.46 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.46 |
| ▸ | EGFR | P00533 | 2/20 | 0.46 |
| ▸ | JAK3 | P52333 | 1/20 | 0.46 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.46 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.45 |
| ▸ | FLT1 | P17948 | 1/20 | 0.44 |
| ▸ | KDR | P35968 | 2/20 | 0.43 |
| ▸ | SMO | Q99835 | 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 | |
|---|---|---|---|---|
| SCHEMBL6531731 | 0.89 | TNIK (0.49) | MKNK1MAPKAPK2TNIKCDC7ROCK2 | |
| SCHEMBL6531053 | 0.86 | ROCK2 (0.46) | MKNK1MAPKAPK2TNIKCDC7ROCK2 | |
| SCHEMBL1013494 | 0.82 | ABL1 (0.60) | MKNK1MAPKAPK2TNIKCDC7PIK3CA | |
| SCHEMBL6533277 | 0.82 | PIK3CA (0.49) | MKNK1MAPKAPK2TNIKROCK2EGFR | |
| SCHEMBL6530590 | 0.81 | ABL1 (0.60) | MKNK1MAPKAPK2TNIKCDC7ROCK2 | |
| SCHEMBL6529707 | 0.80 | PIK3CA (0.62) | MKNK1MAPKAPK2TNIKCDC7ROCK2 | |
| SCHEMBL6531231 | 0.79 | ROCK2 (0.47) | MKNK1MAPKAPK2ROCK2EGFRJAK3 | |
| SCHEMBL6531088 | 0.79 | KDM4E (0.57) | MKNK1ROCK2JAK3IRAK4PIK3CA | |
| SCHEMBL6530116 | 0.76 | TNIK (0.46) | MKNK1MAPKAPK2TNIKCDC7ROCK2 | |
| SCHEMBL6532132 | 0.75 | CYP1A2 (0.67) | ROCK2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005103036-A1 | PYRIMIDIN-4-YL-1H-INDAZOL-5YL-AMINES AS CHK1 KINASES INHIBITORS | BIOFOCUS DISCOVERY LTD (GB) | 2005-11-03 | — | — | WO | claimed |
| WO-2005103036-A1 | PYRIMIDIN-4-YL-1H-INDAZOL-5YL-AMINES AS CHK1 KINASES INHIBITORS | BIOFOCUS DISCOVERY LTD (GB) | 2005-11-03 | — | — | WO | disclosed |