Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IMPDH2 | P12268 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | NSD2 | O96028 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2011955 | 0.80 | IMPDH2 (0.36) | IMPDH2ALDH1A1HPGDTP53CYP1A2 | |
| SCHEMBL9952125 | 0.79 | IMPDH2 (0.38) | IMPDH2CA1CA2ALDH1A1 | |
| SCHEMBL13724835 | 0.74 | ERN1 (0.36) | PTPN1ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9952114 | 0.73 | MEP1A (0.33) | ERN1 | |
| SCHEMBL29285001 | 0.72 | ERN1 (0.35) | ALDH1A1GAAMAPTMAPK1ERN1 | |
| SCHEMBL2012031 | 0.72 | ERN1 (0.33) | PTPN1HPGDCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9952911 | 0.72 | CYP3A4 (0.35) | ALDH1A1HPGDCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL23887046 | 0.70 | ERN1 (0.39) | CA1CA2ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL5671922 | 0.70 | MEN1 (0.37) | CA1CA2PTPN1ALDH1A1CYP3A4 | |
| SCHEMBL28418499 | 0.70 | ERN1 (0.46) | CA2ALDH1A1HPGDCYP1A2CYP3A4 |
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 |