Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 5/20 | 0.37 |
| ▸ | JAK1 | P23458 | 3/20 | 0.37 |
| ▸ | TYK2 | P29597 | 3/20 | 0.37 |
| ▸ | JAK3 | P52333 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | IKBKE | Q14164 | 3/20 | 0.35 |
| ▸ | TBK1 | Q9UHD2 | 3/20 | 0.35 |
| ▸ | PI4KB | Q9UBF8 | 4/20 | 0.34 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
| ▸ | PIK3C2A | O00443 | 1/20 | 0.34 |
| ▸ | PIK3C2B | O00750 | 1/20 | 0.34 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | CDK9 | P50750 | 1/20 | 0.34 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.34 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.34 |
| ▸ | EIF2AK3 | Q9NZJ5 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL24577593 | 0.85 | CYP3A4 (0.42) | JAK2JAK1TYK2JAK3CYP3A4 | |
| SCHEMBL24577029 | 0.85 | HDAC6 (0.37) | JAK2JAK1TYK2JAK3CYP3A4 | |
| SCHEMBL24578249 | 0.76 | KDM4E (0.43) | CYP3A4PIK3CAIKBKETBK1PI4KB | |
| SCHEMBL29759932 | 0.75 | PDGFRA (0.48) | CYP3A4PIK3CAIKBKETBK1PI4KB | |
| SCHEMBL24577222 | 0.75 | PDGFRA (0.48) | CYP3A4PIK3CAIKBKETBK1PI4KB | |
| SCHEMBL24578460 | 0.74 | HDAC6 (0.36) | JAK2JAK1TYK2JAK3IKBKE | |
| SCHEMBL24577161 | 0.73 | HDAC6 (0.39) | JAK2JAK1TYK2JAK3CYP3A4 | |
| SCHEMBL24577081 | 0.71 | HDAC6 (0.37) | JAK2JAK1TYK2JAK3CYP3A4 | |
| SCHEMBL30809572 | 0.71 | IKBKE (0.35) | JAK2JAK1TYK2JAK3CYP3A4 | |
| SCHEMBL24577880 | 0.70 | HDAC6 (0.36) | JAK2JAK1TYK2JAK3CYP3A4 |
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 |