Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 11/20 | 0.62 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.61 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.61 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.61 |
| ▸ | TP53 | P04637 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.52 |
| ▸ | EGFR | P00533 | 1/20 | 0.48 |
| ▸ | FLT1 | P17948 | 1/20 | 0.48 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.48 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.47 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.47 |
| ▸ | CDK9 | P50750 | 1/20 | 0.47 |
| ▸ | CDC7 | O00311 | 1/20 | 0.46 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.46 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6533277 | 0.86 | PIK3CA (0.49) | PIK3CAPIK3CDPIK3CBPIK3CGTNIK | |
| SCHEMBL6531088 | 0.85 | KDM4E (0.57) | PIK3CAMAPTMKNK1CCNT1CDK9 | |
| SCHEMBL6530590 | 0.81 | ABL1 (0.60) | PIK3CATNIKEGFRMKNK1MAPKAPK2 | |
| SCHEMBL6532132 | 0.81 | CYP1A2 (0.67) | TP53CCNT1CDK9ROCK2ROCK1 | |
| SCHEMBL6531231 | 0.81 | ROCK2 (0.47) | PIK3CAPIK3CDPIK3CBPIK3CGEGFR | |
| SCHEMBL6530951 | 0.80 | MKNK1 (0.51) | PIK3CATNIKEGFRFLT1MKNK1 | |
| SCHEMBL6531731 | 0.80 | TNIK (0.49) | PIK3CATNIKEGFRMKNK1MAPKAPK2 | |
| SCHEMBL2468192 | 0.78 | PIK3CA (0.84) | PIK3CAPIK3CDPIK3CBPIK3CGROCK2 | |
| SCHEMBL1013494 | 0.78 | ABL1 (0.60) | PIK3CATNIKMKNK1MAPKAPK2CDC7 | |
| SCHEMBL6131765 | 0.77 | PIK3CA (1.00) | PIK3CAPIK3CDPIK3CBPIK3CGROCK2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005103036-A1 | PYRIMIDIN-4-YL-1H-INDAZOL-5YL-AMINES AS CHK1 KINASES INHIBITORS | BIOFOCUS DISCOVERY LTD (GB) | 2005-11-03 | — | — | WO | claimed |