Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 14/20 | 0.37 |
| ▸ | CTSA | P10619 | 1/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | APLNR | P35414 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9953247 | 0.89 | PIK3CD (0.36) | PIK3CDCTSAHCRTR1HCRTR2 | |
| SCHEMBL9952249 | 0.87 | HCRTR1 (0.38) | PIK3CDCTSAHCRTR1HCRTR2CNR2 | |
| SCHEMBL9929633 | 0.81 | PIK3CD (0.47) | PIK3CD | |
| Hydrochloric Acid SCHEMBL9929471 | 0.80 | PIK3CD (0.46) | PIK3CDCTSA | |
| Hydrochloric Acid SCHEMBL17337368 | 0.79 | PIK3CD (0.53) | PIK3CD | |
| SCHEMBL9952247 | 0.77 | PIK3CD (0.46) | PIK3CDCTSAAPLNR | |
| SCHEMBL9929037 | 0.74 | PIK3CD (0.41) | PIK3CDCTSACNR2APLNR | |
| SCHEMBL9952356 | 0.72 | NQO2 (0.43) | — | |
| SCHEMBL9952282 | 0.72 | NQO2 (0.43) | — | |
| SCHEMBL14742496 | 0.71 | PIK3CD (0.55) | PIK3CD |
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 |