Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 9/20 | 0.42 |
| ▸ | BCR | P11274 | 9/20 | 0.42 |
| ▸ | RAF1 | P04049 | 2/20 | 0.34 |
| ▸ | RIPK1 | Q13546 | 8/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29921953 | 1.00 | ABL1 (0.42) | ABL1BCRRAF1RIPK1NTRK1 | |
| SCHEMBL29921505 | 0.90 | ABL1 (0.44) | ABL1BCRRAF1RIPK1 | |
| SCHEMBL29921432 | 0.87 | ABL1 (0.57) | ABL1BCRRAF1 | |
| SCHEMBL29071266 | 0.87 | ABL1 (0.46) | ABL1BCRRAF1RIPK1 | |
| SCHEMBL29921947 | 0.87 | ABL1 (0.46) | ABL1BCRRAF1RIPK1 | |
| SCHEMBL29071292 | 0.87 | ABL1 (0.57) | ABL1BCRRAF1 | |
| SCHEMBL29921912 | 0.85 | ABL1 (0.56) | ABL1BCRRAF1 | |
| SCHEMBL29071319 | 0.85 | ABL1 (0.56) | ABL1BCRRAF1 | |
| SCHEMBL29921871 | 0.82 | ABL1 (0.38) | ABL1BCRRAF1RIPK1 | |
| SCHEMBL29921965 | 0.78 | ABL1 (0.51) | ABL1BCRRAF1RIPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116761801-A | Heterocyclic compounds having protein kinase inhibitory activity, pharmaceutical compositions containing the same, and methods of preparing and using the same | 四川科伦博泰生物医药股份有限公司 | 2023-09-15 | — | — | CN | disclosed |