Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 6/20 | 0.43 |
| ▸ | CCNC | P24863 | 1/20 | 0.43 |
| ▸ | CDK8 | P49336 | 1/20 | 0.43 |
| ▸ | CDK19 | Q9BWU1 | 1/20 | 0.43 |
| ▸ | GRM2 | Q14416 | 3/20 | 0.40 |
| ▸ | CDK7 | P50613 | 1/20 | 0.39 |
| ▸ | CHUK | O15111 | 3/20 | 0.38 |
| ▸ | MAPK8 | P45983 | 3/20 | 0.38 |
| ▸ | CAMKK2 | Q96RR4 | 3/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.38 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.38 |
| ▸ | INSR | P06213 | 2/20 | 0.38 |
| ▸ | ITK | Q08881 | 1/20 | 0.38 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30501252 | 0.94 | CHEK1 (0.42) | CHEK1CCNCCDK8CDK19GRM2 | |
| SCHEMBL30501399 | 0.92 | IRAK4 (0.39) | CHEK1CCNCCDK8CDK19GRM2 | |
| SCHEMBL30501477 | 0.89 | HTT (0.43) | CCNCCDK8CDK19IRAK4HPGD | |
| SCHEMBL30501420 | 0.86 | CDK2 (0.42) | CHEK1ROCK2IRAK4ROCK1 | |
| SCHEMBL30501454 | 0.86 | IRAK4 (0.38) | CHEK1CCNCCDK8CDK19GRM2 | |
| SCHEMBL30501368 | 0.85 | CDK2 (0.42) | CHEK1ROCK2IRAK4ROCK1 | |
| SCHEMBL30501428 | 0.85 | ROCK2 (0.41) | CHEK1CCNCCDK8CDK19ROCK2 | |
| SCHEMBL30501414 | 0.84 | ROCK2 (0.40) | ROCK2IRAK4ROCK1HPGD | |
| SCHEMBL30501372 | 0.83 | HTT (0.43) | CCNCCDK8CDK19IRAK4HPGD | |
| SCHEMBL30501435 | 0.83 | CHEK1 (0.49) | CHEK1CCNCCDK8CDK19GRM2 |
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-111032642-B | Kinase inhibitors and methods of making and using the same | 里格尔药品股份有限公司 | 2023-07-18 | — | — | CN | disclosed |