Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 2/20 | 0.33 |
| ▸ | BCR | P11274 | 2/20 | 0.33 |
| ▸ | NEK7 | Q8TDX7 | 3/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | PIK3CD | O00329 | 4/20 | 0.31 |
| ▸ | ATR | Q13535 | 1/20 | 0.31 |
| ▸ | RIPK1 | Q13546 | 5/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29921409 | 0.85 | PARP1 (0.37) | ABL1BCRLMNAPIK3CDRIPK1 | |
| SCHEMBL29922008 | 0.83 | RIPK1 (0.40) | ABL1BCRRIPK1 | |
| SCHEMBL29071273 | 0.83 | RIPK1 (0.40) | ABL1BCRRIPK1 | |
| SCHEMBL29071280 | 0.82 | RAF1 (0.36) | ABL1BCRPIK3CDRIPK1 | |
| SCHEMBL29921315 | 0.79 | RAF1 (0.39) | — | |
| SCHEMBL29071530 | 0.78 | RAF1 (0.34) | ABL1BCR | |
| SCHEMBL29921890 | 0.77 | RAF1 (0.39) | ABL1BCRRIPK1 | |
| SCHEMBL29071309 | 0.77 | RAF1 (0.39) | ABL1BCRRIPK1 | |
| SCHEMBL29071497 | 0.76 | ABL1 (0.42) | ABL1BCRRIPK1 | |
| SCHEMBL29921498 | 0.76 | ABL1 (0.42) | ABL1BCRRIPK1 |
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 |