Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.45 |
| ▸ | PAK1 | Q13153 | 2/20 | 0.45 |
| ▸ | SIRT5 | Q9NXA8 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | PLK1 | P53350 | 2/20 | 0.41 |
| ▸ | KDR | P35968 | 2/20 | 0.40 |
| ▸ | CDK2 | P24941 | 2/20 | 0.39 |
| ▸ | CDK9 | P50750 | 2/20 | 0.39 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 2/20 | 0.38 |
| ▸ | PLK4 | O00444 | 1/20 | 0.38 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.38 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.38 |
| ▸ | GNAI2 | P04899 | 1/20 | 0.38 |
| ▸ | LCK | P06239 | 1/20 | 0.38 |
| ▸ | RET | P07949 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3411147 | 0.88 | BRD4 (0.46) | BRD4PAK1MAPTNPC1PLK1 | |
| SCHEMBL3412096 | 0.87 | BRD4 (0.46) | BRD4PAK1SIRT5MAPTNPC1 | |
| SCHEMBL3412716 | 0.85 | PAK1 (0.45) | BRD4PAK1SIRT5MAPTNPC1 | |
| SCHEMBL3406186 | 0.84 | KDR (0.42) | BRD4PAK1MAPTPLK1KDR | |
| SCHEMBL3407097 | 0.81 | BRD4 (0.41) | BRD4PAK1MAPTNPC1PLK1 | |
| SCHEMBL3410224 | 0.81 | TP53 (0.43) | MAPTPLK1KDRCDK2EGFR | |
| SCHEMBL3412792 | 0.81 | KDR (0.48) | PAK1MAPTPLK1KDRCDK2 | |
| SCHEMBL3407143 | 0.81 | PSEN1 (0.51) | BRD4PAK1 | |
| SCHEMBL3410539 | 0.81 | MAPT (0.43) | BRD4PAK1SIRT5MAPTNPC1 | |
| SCHEMBL3412596 | 0.81 | PLK1 (0.42) | BRD4PAK1MAPTNPC1PLK1 |
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 |