Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 3/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.38 |
| ▸ | SYK | P43405 | 1/20 | 0.37 |
| ▸ | NQO2 | P16083 | 1/20 | 0.37 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.37 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.37 |
| ▸ | NAMPT | P43490 | 1/20 | 0.37 |
| ▸ | KLK7 | P49862 | 1/20 | 0.36 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9954419 | 0.93 | PDE4B (0.41) | PDE4BIDO1HTTSIGMAR1SYK | |
| SCHEMBL9952815 | 0.84 | PDE4B (0.41) | PDE4BHTTSIGMAR1MAPTTP53 | |
| SCHEMBL9929328 | 0.82 | PDE4B (0.44) | PDE4BHTTSYKITGB3ITGA2B | |
| SCHEMBL9952998 | 0.79 | MEN1 (0.41) | IDO1HTTKEAP1NFE2L2DRD2 | |
| SCHEMBL14742531 | 0.78 | SMN1; SMN2 (0.38) | PDE4BSIGMAR1TSHRKDM4EALDH1A1 | |
| SCHEMBL14742321 | 0.78 | SMN1; SMN2 (0.38) | PDE4BSIGMAR1TSHRKDM4EALDH1A1 | |
| SCHEMBL9929204 | 0.78 | PDE4B (0.43) | PDE4BHTTSIGMAR1NPSR1CHRM4 | |
| SCHEMBL9952322 | 0.77 | SMN1; SMN2 (0.38) | PDE4BSIGMAR1KDM4ECHRM4 | |
| SCHEMBL9928806 | 0.77 | PDE4B (0.42) | PDE4BSYKITGB3ITGA2BKLK7 | |
| Hydrochloric Acid SCHEMBL9952456 | 0.77 | SMN1; SMN2 (0.37) | PDE4BSIGMAR1KDM4ECHRM4 |
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 |