Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.36 |
| ▸ | USP2 | O75604 | 3/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.36 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.36 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | KMO | O15229 | 2/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | JAK3 | P52333 | 1/20 | 0.35 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9960559 | 0.89 | ALDH1A1 (0.36) | ALDH1A1CYP1A2CYP3A4CLK4USP2 | |
| SCHEMBL9952872 | 0.85 | KMO (0.38) | ALDH1A1CYP1A2CYP3A4CLK4USP2 | |
| SCHEMBL9953217 | 0.85 | PIK3CD (0.36) | PIK3CDALDH1A1CYP1A2CYP3A4CLK4 | |
| SCHEMBL9929206 | 0.85 | PIK3CD (0.56) | PIK3CDBRD4KMOJAK2JAK3 | |
| SCHEMBL9952025 | 0.83 | MAP4K4 (0.37) | ALDH1A1CYP1A2CYP3A4CLK4USP2 | |
| SCHEMBL9928810 | 0.77 | PIK3CD (0.58) | PIK3CDPIK3CBBRD4KMO | |
| SCHEMBL9952266 | 0.76 | PIK3CD (0.46) | PIK3CDALDH1A1CYP1A2CYP3A4CLK4 | |
| SCHEMBL9952453 | 0.75 | PIK3CD (0.42) | PIK3CDALDH1A1CYP1A2CYP3A4CLK4 | |
| SCHEMBL21986437 | 0.74 | LRRK2 (0.39) | PIK3CAJAK2JAK3 | |
| SCHEMBL9952100 | 0.74 | PIK3CD (0.42) | PIK3CDALDH1A1CYP1A2CYP3A4CLK4 |
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 |