Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IMPDH2 | P12268 | 4/20 | 0.37 |
| ▸ | CA2 | P00918 | 10/20 | 0.36 |
| ▸ | CA1 | P00915 | 8/20 | 0.36 |
| ▸ | CA4 | P22748 | 7/20 | 0.36 |
| ▸ | CA6 | P23280 | 5/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL9952629 | 0.83 | IMPDH2 (0.47) | IMPDH2CA2CA1CA4CA6 | |
| SCHEMBL9952136 | 0.81 | MEP1B (0.39) | IMPDH2CA2CA1CA4CA6 | |
| SCHEMBL9952090 | 0.72 | KMT2A (0.41) | IMPDH2CA2CA1CA4CA6 | |
| SCHEMBL9929352 | 0.72 | HSP90AA1 (0.38) | IMPDH2CA2CA1CA4CA6 | |
| SCHEMBL8427155 | 0.71 | KMT2A (0.54) | IMPDH2CA2CA1ALDH1A1MAPT | |
| SCHEMBL9952188 | 0.71 | IMPDH2 (0.39) | IMPDH2ALDH1A1MAPTTDP1KDM4E | |
| SCHEMBL9953161 | 0.70 | IMPDH2 (0.47) | IMPDH2ALDH1A1KDM4EGAASLC2A1 | |
| SCHEMBL9952125 | 0.70 | IMPDH2 (0.38) | IMPDH2CA2CA1CA4CA6 | |
| SCHEMBL9952076 | 0.70 | IMPDH2 (0.47) | IMPDH2ALDH1A1KDM4EGAASLC2A1 | |
| SCHEMBL5273699 | 0.69 | KMT2A (0.38) | IMPDH2ALDH1A1MAPTTDP1MEP1B |
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 |