Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TACR2 | P21452 | 2/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.31 |
| ▸ | SYK | P43405 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | PDE4A | P27815 | 1/20 | 0.30 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.30 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.30 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL25391517 | 0.83 | SMN1; SMN2 (0.38) | SMN1; SMN2HDAC1SLC29A1CYP3A4MAPT | |
| SCHEMBL9936656 | 0.82 | SLC29A1 (0.41) | SMN1; SMN2HDAC1SLC29A1MAPTL3MBTL1 | |
| SCHEMBL9938207 | 0.82 | SMN1; SMN2 (0.34) | SMN1; SMN2TACR2HDAC1SLC29A1 | |
| SCHEMBL9935756 | 0.81 | ADORA1 (0.37) | HDAC1CYP3A4KDM4E | |
| SCHEMBL25390708 | 0.81 | HPGD (0.42) | SMN1; SMN2HDAC1SLC29A1MAPTL3MBTL1 | |
| SCHEMBL25229494 | 0.78 | SMN1; SMN2 (0.42) | SMN1; SMN2TACR2HDAC1SLC29A1CYP3A4 | |
| SCHEMBL3325399 | 0.77 | SMN1; SMN2 (0.41) | SMN1; SMN2HDAC1SLC29A1MAPTL3MBTL1 | |
| SCHEMBL25391923 | 0.77 | SMN1; SMN2 (0.37) | SMN1; SMN2HDAC1SLC29A1CYP3A4MAPT | |
| SCHEMBL9937094 | 0.75 | HDAC1 (0.41) | SMN1; SMN2HDAC1L3MBTL1KDM4EPDE4B | |
| SCHEMBL31339118 | 0.75 | PIM1 (0.40) | SMN1; SMN2HDAC1SLC29A1PDE10AMAPT |
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-2651951-A1 | TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE | F.HOFFMANN-LA ROCHE AG (CH) | 2013-10-23 | — | — | EP | disclosed |
| WO-2012082997-A1 | TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE | F. HOFFMANN-LA-ROCHE AG (CH) | 2012-06-21 | — | — | WO | disclosed |