Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 7/20 | 0.72 |
| ▸ | GSK3A | P49840 | 3/20 | 0.72 |
| ▸ | RGS4 | P49798 | 7/20 | 0.70 |
| ▸ | RGS8 | P57771 | 7/20 | 0.70 |
| ▸ | PRKCA | P17252 | 2/20 | 0.62 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.54 |
| ▸ | CDK1 | P06493 | 1/20 | 0.54 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.54 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.54 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL2107216 | 0.85 | GSK3B (1.00) | GSK3BGSK3ARGS4RGS8PRKCA | |
| SCHEMBL29239069 | 0.84 | GSK3B (0.74) | GSK3BGSK3ARGS4RGS8PRKCA | |
| SCHEMBL29239192 | 0.83 | GSK3B (0.72) | GSK3BGSK3ARGS4RGS8PRKCA | |
| SCHEMBL2107221 | 0.82 | RGS4 (1.00) | GSK3BGSK3ARGS4RGS8PRKCA | |
| SCHEMBL15212631 | 0.80 | GSK3B (0.78) | GSK3BGSK3ARGS4RGS8PRKCA | |
| Krm-7777 SCHEMBL3384141 | 0.77 | GSK3B (1.00) | GSK3BGSK3ARGS4RGS8PRKCA | |
| SCHEMBL2106404 | 0.76 | GSK3B (0.75) | GSK3BGSK3ARGS4RGS8PRKCA | |
| SCHEMBL29239055 | 0.76 | GSK3B (0.76) | GSK3BGSK3ARGS4RGS8PRKCA | |
| SCHEMBL29239093 | 0.75 | GSK3B (0.69) | GSK3BGSK3ARGS4RGS8PRKCA | |
| SCHEMBL13517889 | 0.75 | RGS4 (0.88) | GSK3BGSK3ARGS4RGS8PRKCA |
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 |
|---|---|---|---|---|---|---|---|
| CN-113827592-B | Application of thiadiazolidinedione compound in treating pathogenic infection | 中国科学院上海药物研究所 | 2024-06-18 | — | — | CN | disclosed |