Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNA2 | P20248 | 4/20 | 0.38 |
| ▸ | CDK2 | P24941 | 4/20 | 0.38 |
| ▸ | CCNK | O75909 | 3/20 | 0.38 |
| ▸ | CDK9 | P50750 | 3/20 | 0.38 |
| ▸ | CCND3 | P30281 | 2/20 | 0.38 |
| ▸ | CDK6 | Q00534 | 2/20 | 0.38 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.35 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.34 |
| ▸ | MAPK3 | P27361 | 6/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | ULK1 | O75385 | 1/20 | 0.34 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28085703 | 0.83 | JAK3 (0.40) | EGFR | |
| SCHEMBL24716303 | 0.81 | KMT2A (0.44) | CCNA2CDK2CCNKCDK9CCND3 | |
| SCHEMBL30223473 | 0.75 | CCNA2 (0.44) | CCNA2CDK2CCNKCDK9CCND3 | |
| SCHEMBL24073506 | 0.75 | CCNA2 (0.44) | CCNA2CDK2CCNKCDK9CCND3 | |
| SCHEMBL25839416 | 0.72 | LRRK2 (0.43) | CCNA2CDK2CCNKCDK9CCND3 | |
| SCHEMBL16385536 | 0.72 | CCNA2 (0.43) | CCNA2CDK2CCNKCDK9CCND3 | |
| SCHEMBL16204249 | 0.71 | CDK9 (0.41) | CCNA2CDK2CCNKCDK9CCND3 | |
| SCHEMBL2062564 | 0.70 | IGF1R (0.54) | CCNA2CDK2CCNKCDK9CCND3 | |
| SCHEMBL19557698 | 0.70 | CCNA2 (0.38) | CCNA2CDK2CCNKCDK9CCND3 | |
| SCHEMBL19557729 | 0.70 | MAPK8 (0.42) | CCNA2CDK2CCNKCDK9CCND3 |
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-105801603-A | ALK inhibitor with macrocyclic structure and preparation method thereof | 成都倍特药业有限公司 | 2016-07-27 | — | — | CN | disclosed |