Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 13/20 | 0.56 |
| ▸ | SRC | P12931 | 11/20 | 0.56 |
| ▸ | RET | P07949 | 6/20 | 0.56 |
| ▸ | JAK2 | O60674 | 2/20 | 0.56 |
| ▸ | CDC7 | O00311 | 1/20 | 0.56 |
| ▸ | PLK4 | O00444 | 1/20 | 0.56 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.56 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.56 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.56 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.56 |
| ▸ | INSR | P06213 | 1/20 | 0.56 |
| ▸ | LCK | P06239 | 1/20 | 0.56 |
| ▸ | FYN | P06241 | 1/20 | 0.56 |
| ▸ | CDK1 | P06493 | 1/20 | 0.56 |
| ▸ | ROS1 | P08922 | 1/20 | 0.56 |
| ▸ | FER | P16591 | 1/20 | 0.56 |
| ▸ | PRKACA | P17612 | 1/20 | 0.56 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.56 |
| ▸ | CDK2 | P24941 | 1/20 | 0.56 |
| ▸ | MARK3 | P27448 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL22243317 | 0.92 | KDR (0.66) | KDRSRCRETJAK2CDC7 | |
| SCHEMBL22243341 | 0.87 | KDR (0.74) | KDRSRCRETJAK2CDC7 | |
| SCHEMBL22243293 | 0.87 | KDR (0.74) | KDRSRCRETJAK2CDC7 | |
| SCHEMBL21540336 | 0.85 | PIK3CD (0.56) | KDRSRCRETJAK2CDC7 | |
| SCHEMBL22243338 | 0.84 | KDR (0.73) | KDRSRCRETJAK2CDC7 | |
| SCHEMBL19871051 | 0.84 | RET (0.56) | KDRSRCRETJAK2CDC7 | |
| SCHEMBL24096479 | 0.82 | SRC (0.61) | KDRSRCRETJAK2CDC7 | |
| SCHEMBL24041301 | 0.80 | RET (0.47) | KDRSRCRETJAK2EGFR | |
| SCHEMBL19565381 | 0.79 | EGFR (0.52) | RETJAK2EGFRBTKJAK3 | |
| SCHEMBL22243320 | 0.79 | KDR (0.87) | KDRSRCRETJAK2CDC7 |
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-2020147798-A1 | CYCLIC MOLECULES AS BRUTON'S TYROSINE KINASE INHIBITOR | 明慧医药（上海）有限公司 | 2020-07-23 | — | — | WO | disclosed |