Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 2/20 | 0.42 |
| ▸ | GSK3A | P49840 | 2/20 | 0.42 |
| ▸ | GSK3B | P49841 | 2/20 | 0.42 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.32 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 3/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | DPP4 | P27487 | 1/20 | 0.31 |
| ▸ | WNT3A | P56704 | 1/20 | 0.31 |
| ▸ | CD38 | P28907 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2909439 | 0.89 | CDK1 (0.40) | CDK1GSK3AGSK3BL3MBTL1ALDH1A1 | |
| SCHEMBL2911937 | 0.88 | CDK1 (0.42) | CDK1GSK3AGSK3BL3MBTL1ALDH1A1 | |
| SCHEMBL2904020 | 0.88 | CDK1 (0.41) | CDK1GSK3AGSK3BL3MBTL1ALDH1A1 | |
| SCHEMBL2912739 | 0.85 | CDK1 (0.40) | CDK1GSK3AGSK3BL3MBTL1ALDH1A1 | |
| SCHEMBL2911880 | 0.85 | CDK1 (0.40) | CDK1GSK3AGSK3BL3MBTL1ALDH1A1 | |
| SCHEMBL2912330 | 0.84 | CDK1 (0.40) | CDK1GSK3AGSK3BL3MBTL1ALDH1A1 | |
| SCHEMBL2909662 | 0.84 | GSK3A (0.44) | CDK1GSK3AGSK3BL3MBTL1ALDH1A1 | |
| SCHEMBL2909924 | 0.84 | CDK1 (0.40) | CDK1GSK3AGSK3BL3MBTL1ALDH1A1 | |
| SCHEMBL2903811 | 0.83 | POLB (0.43) | CDK1GSK3AGSK3BALDH1A1POLB | |
| SCHEMBL2913331 | 0.83 | CDK1 (0.41) | CDK1GSK3AGSK3BL3MBTL1ALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1537099-B1 | PYRROLE BASED INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 | NOVARTIS VACCINES & DIAGNOSTIC (US) | 2010-08-11 | — | — | EP | disclosed |