Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.35 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 3/20 | 0.34 |
| ▸ | JAK1 | P23458 | 2/20 | 0.34 |
| ▸ | TYK2 | P29597 | 2/20 | 0.34 |
| ▸ | JAK3 | P52333 | 2/20 | 0.34 |
| ▸ | KAT5 | Q92993 | 1/20 | 0.34 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MARK3 | P27448 | 2/20 | 0.33 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.32 |
| ▸ | MAP3K5 | Q99683 | 2/20 | 0.32 |
| ▸ | KIT | P10721 | 1/20 | 0.32 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.32 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL24577029 | 0.89 | HDAC6 (0.37) | HDAC6IKBKETBK1JAK2JAK1 | |
| SCHEMBL24577081 | 0.89 | HDAC6 (0.37) | HDAC6IKBKETBK1JAK2JAK1 | |
| SCHEMBL24577880 | 0.87 | HDAC6 (0.36) | HDAC6IKBKETBK1JAK2JAK1 | |
| SCHEMBL24577246 | 0.81 | KIT (0.40) | MARK3KITMAPK1CHRM1PDGFRA | |
| SCHEMBL24577111 | 0.80 | PDGFRA (0.44) | HDAC6IKBKETBK1JAK2JAK1 | |
| SCHEMBL24578458 | 0.79 | HDAC6 (0.36) | HDAC6IKBKETBK1JAK2JAK1 | |
| SCHEMBL24578460 | 0.79 | HDAC6 (0.36) | HDAC6IKBKETBK1JAK2JAK1 | |
| SCHEMBL29759788 | 0.78 | IKBKE (0.39) | HDAC6IKBKETBK1IRAK4KDM1A | |
| Hydrochloric Acid SCHEMBL29759908 | 0.77 | PDGFRA (0.41) | HDAC6IKBKETBK1JAK2JAK1 | |
| SCHEMBL27185302 | 0.77 | KIT (0.44) | HDAC6IKBKETBK1JAK2JAK1 |
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-2022136509-A1 | PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS | ACTELION PHARMACEUTICALS LTD (CH) | 2022-06-30 | — | — | WO | disclosed |