Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 1/20 | 0.51 |
| ▸ | AXL | P30530 | 3/20 | 0.51 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.49 |
| ▸ | CDK2 | P24941 | 7/20 | 0.49 |
| ▸ | CCNA2 | P20248 | 6/20 | 0.49 |
| ▸ | AURKA | O14965 | 3/20 | 0.49 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.49 |
| ▸ | MAPK9 | P45984 | 3/20 | 0.48 |
| ▸ | MAPK10 | P53779 | 3/20 | 0.48 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.47 |
| ▸ | CDK4 | P11802 | 1/20 | 0.46 |
| ▸ | CCNK | O75909 | 4/20 | 0.46 |
| ▸ | CCND3 | P30281 | 4/20 | 0.46 |
| ▸ | CDK9 | P50750 | 4/20 | 0.46 |
| ▸ | CDK6 | Q00534 | 4/20 | 0.46 |
| ▸ | JAK2 | O60674 | 1/20 | 0.46 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL25839528 | 0.87 | PTK2 (0.52) | NTRK1AXLPTK2CDK2CCNA2 | |
| SCHEMBL24073135 | 0.84 | AXL (0.70) | AXLPTK2CDK2CCNA2AURKA | |
| SCHEMBL21446899 | 0.83 | AXL (0.57) | AXLPTK2CDK2CCNA2AURKA | |
| SCHEMBL25838913 | 0.82 | AXL (0.54) | AXLPTK2CDK2CCNA2AURKA | |
| SCHEMBL25838868 | 0.81 | AXL (0.53) | AXLPTK2AURKAAURKBALK | |
| SCHEMBL21438066 | 0.80 | AXL (0.73) | AXLPTK2AURKAAURKBALK | |
| SCHEMBL31173410 | 0.80 | AXL (0.73) | AXLPTK2AURKAAURKBALK | |
| SCHEMBL25299781 | 0.77 | PTK2 (0.65) | NTRK1AXLPTK2AURKAAURKB | |
| SCHEMBL25839353 | 0.74 | AXL (0.62) | AXLPTK2CDK2CCNA2AURKA | |
| SCHEMBL25838551 | 0.74 | AXL (0.62) | AXLPTK2CDK2CCNA2AURKA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023134582-A1 | PYRIMIDINE-2,4-DIAMINE DERIVATIVES AS WELL AS PREPARATION METHOD THEREFOR AND USE THEREOF | 上海立森印迹医药技术有限公司 | 2023-07-20 | — | — | WO | disclosed |