Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 7/20 | 0.45 |
| ▸ | GSK3B | P49841 | 3/20 | 0.44 |
| ▸ | GSK3A | P49840 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20204946 | 1.00 | IRAK4 (0.45) | IRAK4GSK3BGSK3ATSHRALOX15 | |
| SCHEMBL20205214 | 0.86 | GSK3A (0.53) | IRAK4GSK3BGSK3AMAPK1MAPT | |
| SCHEMBL29939856 | 0.85 | TSHR (0.51) | IRAK4GSK3BGSK3ATSHRALOX15 | |
| SCHEMBL20204972 | 0.85 | TSHR (0.51) | IRAK4GSK3BGSK3ATSHRALOX15 | |
| SCHEMBL20204994 | 0.83 | GSK3A (0.54) | GSK3BGSK3ATSHRALOX15MAPK1 | |
| SCHEMBL20205097 | 0.82 | IRAK4 (0.46) | IRAK4GSK3BGSK3ATSHRALOX15 | |
| SCHEMBL29939117 | 0.81 | MAPK1 (0.52) | IRAK4GSK3BGSK3ATSHRALOX15 | |
| SCHEMBL20205173 | 0.81 | MAPK1 (0.52) | IRAK4GSK3BGSK3ATSHRALOX15 | |
| SCHEMBL20205219 | 0.81 | GSK3A (0.49) | GSK3BGSK3ATSHRALOX15MAPK1 | |
| SCHEMBL29939489 | 0.81 | GSK3A (0.49) | GSK3BGSK3ATSHRALOX15MAPK1 |
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-110545817-B | GSK-3 inhibitors | 百时美施贵宝公司 | 2022-11-15 | — | — | CN | disclosed |