Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 5/20 | 0.71 |
| ▸ | CDK4 | P11802 | 5/20 | 0.55 |
| ▸ | CCND1 | P24385 | 5/20 | 0.55 |
| ▸ | CCND2 | P30279 | 5/20 | 0.55 |
| ▸ | CCND3 | P30281 | 5/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | USP2 | O75604 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | PRKDC | P78527 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CASP1 | P29466 | 2/20 | 0.46 |
| ▸ | CASP7 | P55210 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CSF1R | P07333 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1599121 | 0.80 | GSK3B (1.00) | GSK3BCDK4CCND1CCND2CCND3 | |
| SCHEMBL5803855 | 0.80 | GSK3B (1.00) | GSK3BCDK4CCND1CCND2CCND3 | |
| SCHEMBL5803009 | 0.80 | GSK3B (0.72) | GSK3BCDK4CCND1CCND2CCND3 | |
| SCHEMBL1600331 | 0.77 | GSK3B (0.67) | GSK3BCDK4CCND1CCND2CCND3 | |
| SCHEMBL5803243 | 0.72 | GSK3B (0.76) | GSK3BCYP1A2CYP3A4CYP2C9MEN1 | |
| SCHEMBL1600525 | 0.72 | CDK4 (0.65) | GSK3BCDK4CCND1CCND2CCND3 | |
| SCHEMBL5807003 | 0.72 | GSK3B (0.76) | GSK3BCDK4CCND1CCND2CCND3 | |
| SCHEMBL5262825 | 0.71 | CDK4 (1.00) | GSK3BCDK4CCND1CCND2CCND3 | |
| SCHEMBL1600529 | 0.70 | CDK4 (0.66) | GSK3BCDK4CCND1CCND2CCND3 | |
| SCHEMBL4520036 | 0.69 | ADORA2A (0.72) | CYP1A2CYP3A4CYP2C9MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006091737-A1 | MODULATORS OF GSK-3 ACTIVITY | KEMIA, INC. (US) | 2006-08-31 | — | — | WO | disclosed |