Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 8/20 | 0.59 |
| ▸ | PIK3CB | P42338 | 8/20 | 0.59 |
| ▸ | PIK3CG | P48736 | 8/20 | 0.59 |
| ▸ | CDK2 | P24941 | 4/20 | 0.48 |
| ▸ | JAK2 | O60674 | 1/20 | 0.48 |
| ▸ | EGFR | P00533 | 1/20 | 0.48 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.48 |
| ▸ | CDK9 | P50750 | 6/20 | 0.47 |
| ▸ | CCNT1 | O60563 | 5/20 | 0.47 |
| ▸ | RET | P07949 | 2/20 | 0.46 |
| ▸ | CDK4 | P11802 | 2/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | PLK1 | P53350 | 1/20 | 0.42 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.42 |
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
| ▸ | CDK1 | P06493 | 1/20 | 0.41 |
| ▸ | CDK7 | P50613 | 1/20 | 0.41 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.41 |
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 | 0.94 | PIK3CA (0.52) | PIK3CAPIK3CBPIK3CGCDK2JAK2 | |
| SCHEMBL3409953 | 0.91 | PIK3CA (0.49) | PIK3CAPIK3CBPIK3CGCDK2JAK2 | |
| SCHEMBL3407305 | 0.90 | PIK3CA (0.61) | PIK3CAPIK3CBPIK3CGCDK2JAK2 | |
| SCHEMBL3409641 | 0.86 | PIK3CA (0.49) | PIK3CAPIK3CBPIK3CGCDK2JAK2 | |
| SCHEMBL3412384 | 0.84 | AGPAT2 (0.41) | PIK3CAPIK3CBPIK3CGCDK9CCNT1 | |
| SCHEMBL3640612 | 0.81 | AMY1A (0.54) | — | |
| SCHEMBL3408743 | 0.81 | PRKCA (0.62) | EGFRRET | |
| SCHEMBL3409757 | 0.81 | CDK9 (0.47) | PIK3CAPIK3CBPIK3CGCDK2JAK2 | |
| SCHEMBL3412789 | 0.81 | SYK (0.56) | CDK2CDK9CCNT1RET | |
| SCHEMBL3412646 | 0.80 | SYK (0.46) | CDK2CDK9CCNT1RETCDK4 |
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 |