Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.60 |
| ▸ | PDGFRA | P16234 | 3/20 | 0.56 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.56 |
| ▸ | KDR | P35968 | 4/20 | 0.56 |
| ▸ | AURKA | O14965 | 3/20 | 0.56 |
| ▸ | LCK | P06239 | 3/20 | 0.56 |
| ▸ | TEK | Q02763 | 3/20 | 0.56 |
| ▸ | MET | P08581 | 2/20 | 0.56 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.56 |
| ▸ | ABL1 | P00519 | 1/20 | 0.55 |
| ▸ | LYN | P07948 | 1/20 | 0.55 |
| ▸ | SRC | P12931 | 2/20 | 0.54 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL24724228 | 0.97 | EGFR (0.56) | EGFRPDGFRAPDGFRBKDRAURKA | |
| SCHEMBL22972010 | 0.85 | MAPT (0.52) | KDR | |
| SCHEMBL22972142 | 0.85 | EGFR (0.66) | EGFRPDGFRAPDGFRBKDRAURKA | |
| SCHEMBL7480997 | 0.85 | PDGFRA (0.75) | PDGFRAKDR | |
| SCHEMBL8552546 | 0.83 | KDR (0.50) | PDGFRAPDGFRBKDRAURKALCK | |
| SCHEMBL3901338 | 0.83 | SRC (0.70) | EGFRPDGFRAPDGFRBKDRAURKA | |
| SCHEMBL18688764 | 0.83 | EGFR (0.57) | EGFRPDGFRAPDGFRBKDRAURKA | |
| SCHEMBL31060507 | 0.81 | EGFR (0.70) | EGFRPDGFRAPDGFRBKDRAURKA | |
| SCHEMBL18688770 | 0.81 | EGFR (0.54) | EGFRPDGFRAPDGFRBKDRAURKA | |
| SCHEMBL3900828 | 0.80 | SRC (0.56) | PDGFRAKDRAURKALCKTEK |
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-2021023888-A1 | ISOQUINOLINE DERIVATIVES AS PROTEIN KINASE INHIBITORS | B.C.I. PHARMA (BE) | 2021-02-11 | — | — | WO | disclosed |