Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IGF1R | P08069 | 3/20 | 0.37 |
| ▸ | AURKA | O14965 | 10/20 | 0.37 |
| ▸ | AURKB | Q96GD4 | 9/20 | 0.37 |
| ▸ | EGFR | P00533 | 2/20 | 0.37 |
| ▸ | ITK | Q08881 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | RET | P07949 | 3/20 | 0.36 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.36 |
| ▸ | KDR | P35968 | 2/20 | 0.36 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | PAK4 | O96013 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
| ▸ | FYN | P06241 | 1/20 | 0.36 |
| ▸ | CSF1R | P07333 | 1/20 | 0.36 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.36 |
| ▸ | FLT1 | P17948 | 1/20 | 0.36 |
| ▸ | LTK | P29376 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL24742552 | 0.81 | RET (0.41) | IGF1RAURKAAURKBEGFRITK | |
| SCHEMBL24741818 | 0.80 | AURKA (0.44) | IGF1RAURKAAURKBEGFRITK | |
| SCHEMBL24741794 | 0.80 | AURKA (0.42) | IGF1RAURKAAURKBEGFRITK | |
| SCHEMBL24742001 | 0.79 | AURKA (0.43) | AURKAAURKBPAK4NTRK3NTRK2 | |
| SCHEMBL24742498 | 0.79 | AURKA (0.41) | IGF1RAURKAAURKBEGFRITK | |
| SCHEMBL24742519 | 0.78 | AURKB (0.41) | AURKAAURKBCYP2D6RETGSK3B | |
| SCHEMBL24741856 | 0.77 | RET (0.35) | IGF1RAURKAAURKBRETFGFR1 | |
| SCHEMBL24743027 | 0.77 | AURKA (0.43) | AURKAAURKBCYP3A4CYP2D6PAK4 | |
| SCHEMBL24742336 | 0.76 | AURKA (0.39) | AURKAAURKBEGFRITKCYP3A4 | |
| SCHEMBL24743112 | 0.75 | RET (0.40) | AURKAAURKBCYP3A4CYP2D6RET |
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-2022206888-A1 | CDK2 INHIBITORS AND USE THEREOF | QILU REGOR THERAPEUTICS INC. (CN) | 2022-10-06 | — | — | WO | disclosed |