Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3A | P49840 | 2/20 | 0.38 |
| ▸ | GSK3B | P49841 | 2/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.38 |
| ▸ | CD38 | P28907 | 6/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | PBK | Q96KB5 | 1/20 | 0.31 |
| ▸ | AXL | P30530 | 1/20 | 0.31 |
| ▸ | FLT3 | P36888 | 1/20 | 0.31 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.31 |
| ▸ | MERTK | Q12866 | 1/20 | 0.31 |
| ▸ | GAS6 | Q14393 | 1/20 | 0.31 |
| ▸ | CSF1R | P07333 | 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 | |
|---|---|---|---|---|
| SCHEMBL2913331 | 0.92 | CDK1 (0.41) | GSK3AGSK3BCDK1CD38ALDH1A1 | |
| SCHEMBL2903761 | 0.86 | CDK1 (0.38) | GSK3AGSK3BCDK1CD38ALDH1A1 | |
| SCHEMBL2909762 | 0.86 | CDK1 (0.38) | GSK3AGSK3BCDK1CD38ALDH1A1 | |
| SCHEMBL2911937 | 0.85 | CDK1 (0.42) | GSK3AGSK3BCDK1ALDH1A1MAPT | |
| SCHEMBL2909662 | 0.85 | GSK3A (0.44) | GSK3AGSK3BCDK1ALDH1A1MAPT | |
| SCHEMBL2904020 | 0.83 | CDK1 (0.41) | GSK3AGSK3BCDK1ALDH1A1MAPT | |
| SCHEMBL2903846 | 0.83 | GSK3A (0.41) | GSK3AGSK3BCDK1ALDH1A1MAPT | |
| SCHEMBL2904160 | 0.83 | GSK3A (0.41) | GSK3AGSK3BCDK1ALDH1A1MAPT | |
| SCHEMBL2909976 | 0.83 | GSK3A (0.39) | GSK3AGSK3BCDK1ALDH1A1MAPT | |
| SCHEMBL2904171 | 0.82 | GSK3A (0.38) | GSK3AGSK3BCDK1CD38ALDH1A1 |
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 |