Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 4/20 | 0.49 |
| ▸ | PIK3CB | P42338 | 4/20 | 0.49 |
| ▸ | PIK3CG | P48736 | 4/20 | 0.49 |
| ▸ | RET | P07949 | 2/20 | 0.48 |
| ▸ | CDK9 | P50750 | 6/20 | 0.46 |
| ▸ | AURKB | Q96GD4 | 5/20 | 0.46 |
| ▸ | AURKA | O14965 | 4/20 | 0.46 |
| ▸ | GSK3B | P49841 | 2/20 | 0.46 |
| ▸ | FLT3 | P36888 | 2/20 | 0.46 |
| ▸ | KDR | P35968 | 2/20 | 0.46 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.46 |
| ▸ | ABL1 | P00519 | 1/20 | 0.46 |
| ▸ | LCK | P06239 | 1/20 | 0.46 |
| ▸ | MET | P08581 | 1/20 | 0.46 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.46 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.46 |
| ▸ | FLT1 | P17948 | 1/20 | 0.46 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.46 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.46 |
| ▸ | GSK3A | P49840 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL3409753 | 0.91 | PIK3CA (0.52) | PIK3CAPIK3CBPIK3CGRETCDK9 | |
| SCHEMBL3407822 | 0.91 | PIK3CA (0.59) | PIK3CAPIK3CBPIK3CGRETCDK9 | |
| SCHEMBL3411066 | 0.89 | NPC1 (0.47) | FLT3PDGFRB | |
| SCHEMBL3409641 | 0.86 | PIK3CA (0.49) | PIK3CAPIK3CBPIK3CGRETCDK9 | |
| SCHEMBL3407305 | 0.86 | PIK3CA (0.61) | PIK3CAPIK3CBPIK3CGRETCDK9 | |
| SCHEMBL3406823 | 0.84 | NPC1 (0.39) | AURKBAURKAFLT3PDGFRB | |
| SCHEMBL3407282 | 0.83 | IGF1R (0.42) | PIK3CAPIK3CBPIK3CGRETAURKB | |
| SCHEMBL3408743 | 0.83 | PRKCA (0.62) | RETABL1LCKPDGFRBACVR1 | |
| SCHEMBL3409757 | 0.81 | CDK9 (0.47) | PIK3CAPIK3CBPIK3CGRETCDK9 | |
| SCHEMBL3412789 | 0.81 | SYK (0.56) | RETCDK9CCNT1CDK2 |
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-2257541-A1 | MODULATORS FOR AMYLOID BETA | F. Hoffmann-La Roche AG (CH) | 2010-12-08 | — | — | EP | disclosed |
| WO-2009103652-A1 | MODULATORS FOR AMYLOID BETA | F. HOFFMANN-LA ROCHE AG (CH) | 2009-08-27 | — | — | WO | disclosed |