Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 11/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 11/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 10/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 9/20 | 0.42 |
| ▸ | LMNA | P02545 | 9/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 8/20 | 0.42 |
| ▸ | USP2 | O75604 | 7/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | TSHR | P16473 | 5/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 2/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 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 | |
|---|---|---|---|---|
| SCHEMBL9954211 | 0.84 | LMNA (0.39) | CYP3A4CYP1A2CYP2C19CLK4LMNA | |
| SCHEMBL9952453 | 0.83 | PIK3CD (0.42) | CYP3A4CYP1A2CYP2C19CLK4LMNA | |
| SCHEMBL9953808 | 0.82 | PIK3CD (0.38) | CYP3A4CYP1A2CYP2C19CLK4LMNA | |
| SCHEMBL9952100 | 0.82 | PIK3CD (0.42) | CYP3A4CYP1A2CYP2C19CLK4LMNA | |
| SCHEMBL9953069 | 0.81 | LMNA (0.42) | CYP3A4CYP1A2CYP2C19CLK4LMNA | |
| SCHEMBL9960475 | 0.81 | PIK3CD (0.43) | CYP3A4CYP1A2CYP2C19CLK4LMNA | |
| SCHEMBL9952996 | 0.81 | STK4 (0.38) | CYP3A4CYP1A2CYP2C19CLK4LMNA | |
| SCHEMBL9952040 | 0.80 | CYP1A2 (0.44) | CYP3A4CYP1A2CYP2C19CLK4LMNA | |
| SCHEMBL9953050 | 0.80 | PIK3CD (0.39) | CYP3A4CYP1A2CYP2C19CLK4LMNA | |
| SCHEMBL9929461 | 0.80 | PIK3CD (0.50) | CYP3A4CYP1A2CYP2C19CLK4LMNA |
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 4 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 | claimed |
| WO-2012087881-A1 | N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS | INCYTE CORPORATION (US) | 2012-06-28 | — | — | WO | claimed |
| 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 |