Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKE | Q14164 | 6/20 | 0.35 |
| ▸ | TBK1 | Q9UHD2 | 6/20 | 0.35 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.34 |
| ▸ | IRAK4 | Q9NWZ3 | 5/20 | 0.33 |
| ▸ | JAK2 | O60674 | 5/20 | 0.32 |
| ▸ | JAK1 | P23458 | 1/20 | 0.32 |
| ▸ | TYK2 | P29597 | 1/20 | 0.32 |
| ▸ | JAK3 | P52333 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.30 |
| ▸ | FYN | P06241 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | ROS1 | P08922 | 1/20 | 0.30 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.30 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.30 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL29760011 | 1.00 | IKBKE (0.35) | IKBKETBK1NR3C1IRAK4JAK2 | |
| SCHEMBL24577656 | 0.89 | NR3C1 (0.35) | IKBKETBK1NR3C1IRAK4ALDH1A1 | |
| SCHEMBL24577986 | 0.85 | NR3C1 (0.34) | NR3C1IRAK4 | |
| SCHEMBL29759921 | 0.85 | NR3C1 (0.34) | NR3C1IRAK4 | |
| SCHEMBL24577107 | 0.85 | NR3C1 (0.33) | NR3C1IRAK4 | |
| SCHEMBL29759699 | 0.83 | IKBKE (0.48) | IKBKETBK1IRAK4JAK2JAK1 | |
| SCHEMBL24578823 | 0.83 | IKBKE (0.48) | IKBKETBK1IRAK4JAK2JAK1 | |
| Hydrochloric Acid SCHEMBL29759717 | 0.83 | IKBKE (0.47) | IKBKETBK1IRAK4JAK2JAK1 | |
| SCHEMBL24576902 | 0.82 | NR3C1 (0.32) | NR3C1IRAK4JAK2NTRK1 | |
| SCHEMBL24576905 | 0.81 | NR3C1 (0.35) | NR3C1 |
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 |