Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 17/20 | 0.69 |
| ▸ | IRAK4 | Q9NWZ3 | 3/20 | 0.49 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.47 |
| ▸ | CDK2 | P24941 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL28382785 | 0.97 | CHEK1 (0.66) | CHEK1IRAK4CCNE1CDK2 | |
| SCHEMBL28383357 | 0.97 | CHEK1 (0.65) | CHEK1IRAK4CCNE1CDK2 | |
| SCHEMBL20598462 | 0.85 | CHEK1 (0.65) | CHEK1IRAK4CCNE1CDK2 | |
| SCHEMBL28380657 | 0.84 | IRAK4 (0.64) | CHEK1IRAK4 | |
| SCHEMBL20598751 | 0.82 | CHEK1 (0.62) | CHEK1IRAK4 | |
| SCHEMBL15071640 | 0.82 | CHEK1 (0.84) | CHEK1 | |
| SCHEMBL28383182 | 0.82 | IRAK4 (0.68) | CHEK1IRAK4 | |
| SCHEMBL14206468 | 0.82 | CHEK1 (0.68) | CHEK1CCNE1CDK2 | |
| SCHEMBL14328814 | 0.82 | CHEK1 (0.68) | CHEK1CCNE1CDK2 | |
| SCHEMBL20598191 | 0.82 | CHEK1 (0.61) | CHEK1IRAK4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111032642-A | Kinase inhibitors and methods of making and using | 里格尔药品股份有限公司 | 2020-04-17 | — | — | CN | claimed |
| CN-111032642-A | Kinase inhibitors and methods of making and using | 里格尔药品股份有限公司 | 2020-04-17 | — | — | CN | disclosed |