Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDGFRA | P16234 | 3/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.48 |
| ▸ | KIT | P10721 | 4/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | PI4KB | Q9UBF8 | 4/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.32 |
| ▸ | LCK | P06239 | 1/20 | 0.32 |
| ▸ | SRC | P12931 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.31 |
| ▸ | MTOR | P42345 | 2/20 | 0.31 |
| ▸ | IKBKE | Q14164 | 5/20 | 0.31 |
| ▸ | TBK1 | Q9UHD2 | 5/20 | 0.31 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.30 |
| ▸ | PIK3C2A | O00443 | 1/20 | 0.30 |
| ▸ | PIK3C2B | O00750 | 1/20 | 0.30 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.30 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.30 |
| ▸ | CDK9 | P50750 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29759932 | 1.00 | PDGFRA (0.48) | PDGFRACHRM1HRH3KITROCK2 | |
| SCHEMBL24577177 | 0.90 | PDGFRA (0.46) | PDGFRACHRM1HRH3KITROCK2 | |
| SCHEMBL24578408 | 0.90 | PDGFRA (0.52) | PDGFRACHRM1HRH3KITROCK2 | |
| SCHEMBL24578932 | 0.89 | PDGFRA (0.45) | PDGFRACHRM1HRH3 | |
| SCHEMBL24577612 | 0.89 | PDGFRA (0.45) | PDGFRACHRM1HRH3KITROCK2 | |
| SCHEMBL24578332 | 0.86 | PDGFRA (0.45) | PDGFRACHRM1HRH3 | |
| SCHEMBL24578413 | 0.86 | PDGFRA (0.43) | PDGFRACHRM1HRH3 | |
| SCHEMBL24577857 | 0.86 | PDGFRA (0.46) | PDGFRACHRM1HRH3 | |
| SCHEMBL24577850 | 0.86 | PDGFRA (0.47) | PDGFRACHRM1HRH3 | |
| SCHEMBL24578027 | 0.85 | PDGFRA (0.67) | PDGFRACHRM1HRH3KITROCK2 |
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 |