Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | BTK | Q06187 | 2/20 | 0.36 |
| ▸ | ITK | Q08881 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | BRAF | P15056 | 3/20 | 0.36 |
| ▸ | LCK | P06239 | 3/20 | 0.35 |
| ▸ | KDR | P35968 | 3/20 | 0.35 |
| ▸ | FLT3 | P36888 | 3/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.35 |
| ▸ | FYN | P06241 | 2/20 | 0.35 |
| ▸ | FRK | P42685 | 2/20 | 0.35 |
| ▸ | CLK2 | P49760 | 2/20 | 0.35 |
| ▸ | PTK6 | Q13882 | 2/20 | 0.35 |
| ▸ | NTRK3 | Q16288 | 2/20 | 0.35 |
| ▸ | MINK1 | Q8N4C8 | 2/20 | 0.35 |
| ▸ | SLK | Q9H2G2 | 2/20 | 0.35 |
| ▸ | MAP4K5 | Q9Y4K4 | 2/20 | 0.35 |
| ▸ | PRKD3 | O94806 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12798698 | 0.83 | JAK2 (0.50) | JAK2CYP2C19CYP3A4CYP2D6BRAF | |
| SCHEMBL12657249 | 0.77 | JAK2 (0.54) | JAK2CYP2C19CYP3A4BTKITK | |
| SCHEMBL12573415 | 0.74 | JAK2 (0.40) | JAK2CYP2C19CYP3A4CYP2D6BRAF | |
| SCHEMBL24780533 | 0.74 | JAK2 (0.51) | JAK2CYP2C19CYP3A4BTKITK | |
| SCHEMBL18634000 | 0.73 | JAK2 (0.42) | JAK2CYP2C19CYP3A4CYP2D6BRAF | |
| SCHEMBL29928376 | 0.73 | JAK2 (0.54) | JAK2CYP2C19CYP3A4ITKCYP2D6 | |
| SCHEMBL14883424 | 0.73 | JAK2 (0.54) | JAK2CYP2C19CYP3A4BTKITK | |
| SCHEMBL1666074 | 0.73 | JAK2 (0.54) | JAK2CYP2C19CYP3A4ITKCYP2D6 | |
| SCHEMBL1053943 | 0.73 | JAK2 (0.58) | JAK2CYP2C19CYP3A4CYP2D6LCK | |
| SCHEMBL15155041 | 0.73 | GSK3B (0.56) | JAK2CYP2C19CYP3A4CYP2D6LCK |
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-2022263801-A1 | PROCESS FOR PREPARING PEXIDARTINIB | JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) | 2022-12-22 | — | — | WO | disclosed |