Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 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 | |
|---|---|---|---|---|
| SCHEMBL29600157 | 0.87 | CYP1A2 (0.33) | GAATDP1 | |
| SCHEMBL18050702 | 0.87 | CYP1A2 (0.33) | GAATDP1 | |
| SCHEMBL12592351 | 0.74 | CSNK2A1 (0.38) | GAATDP1 | |
| SCHEMBL5376352 | 0.73 | ALDH1A1 (0.32) | — | |
| Hydrochloric Acid SCHEMBL31329224 | 0.72 | CSNK2A1 (0.37) | GAATDP1 | |
| SCHEMBL10617981 | 0.69 | CSNK2A2 (0.33) | — | |
| SCHEMBL17525007 | 0.69 | HTT (0.35) | PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL30440549 | 0.68 | LMNA (0.31) | — | |
| SCHEMBL9937148 | 0.68 | LMNA (0.31) | — | |
| Hydrochloric Acid SCHEMBL25274167 | 0.67 | LMNA (0.31) | — |
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 |