Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 7/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 5/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MAPK13 | O15264 | 3/20 | 0.35 |
| ▸ | MAPK12 | P53778 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL23396862 | 0.90 | CYP1A2 (0.48) | ALDH1A1CYP1A2CYP2D6CYP3A4MAPK1 | |
| SCHEMBL23396787 | 0.87 | CYP1A2 (0.48) | ALDH1A1CYP1A2CYP2D6CYP3A4MAPK1 | |
| SCHEMBL23396976 | 0.86 | DYRK1A (0.43) | CLK4DYRK1A | |
| SCHEMBL23397023 | 0.85 | HDAC6 (0.35) | MAPK14ALDH1A1CYP1A2CYP2D6CYP3A4 | |
| SCHEMBL23396899 | 0.85 | HDAC1 (0.37) | MAPK14ALDH1A1CYP1A2CYP2D6CYP3A4 | |
| SCHEMBL23397038 | 0.84 | TPH1 (0.40) | MAPK14ALDH1A1CYP1A2CYP2D6CYP3A4 | |
| SCHEMBL23397070 | 0.83 | INSR (0.37) | — | |
| SCHEMBL23396972 | 0.83 | GPR39 (0.40) | ALDH1A1CYP1A2CYP2D6CLK4HSD17B10 | |
| SCHEMBL23396819 | 0.82 | PIM3 (0.36) | — | |
| SCHEMBL23396818 | 0.82 | HDAC1 (0.44) | ALDH1A1CYP1A2CYP2D6CLK4HSD17B10 |
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-3359154-B1 | WNT SIGNALING PATHWAY INHIBITORS AND THERAPEUTIC APPLICATIONS THEREOF | Suzhou Yunxuan Yiyao Keji Youxian Gongsi (CN) | 2021-05-26 | — | — | EP | disclosed |