Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 6/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.32 |
| ▸ | AURKA | O14965 | 4/20 | 0.32 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.32 |
| ▸ | GCGR | P47871 | 1/20 | 0.31 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.30 |
| ▸ | KMO | O15229 | 3/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9953700 | 0.92 | PIK3CD (0.42) | PIK3CDHIF1AAURKANTRK1 | |
| SCHEMBL9928749 | 0.84 | PIK3CD (0.38) | PIK3CDGCGR | |
| SCHEMBL9952134 | 0.81 | PIK3CD (0.43) | PIK3CDHIF1A | |
| Trifluoroacetic Acid SCHEMBL9951953 | 0.81 | PIK3CD (0.41) | PIK3CDHIF1A | |
| SCHEMBL9953057 | 0.80 | PIK3CD (0.44) | PIK3CD | |
| Trifluoroacetic Acid SCHEMBL9952120 | 0.79 | PIK3CD (0.37) | PIK3CDHIF1A | |
| Trifluoroacetic Acid SCHEMBL9952121 | 0.77 | — | — | |
| SCHEMBL9951931 | 0.76 | PIK3CD (0.31) | PIK3CD | |
| SCHEMBL9929308 | 0.76 | PIK3CD (0.47) | PIK3CD | |
| SCHEMBL21986432 | 0.72 | PIK3CD (0.37) | PIK3CDHIF1A |
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-2655374-A1 | N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS | Incyte Corporation (US) | 2013-10-30 | — | — | EP | disclosed |
| WO-2012087881-A1 | N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS | INCYTE CORPORATION (US) | 2012-06-28 | — | — | WO | disclosed |