Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 5/20 | 0.43 |
| ▸ | ULK1 | O75385 | 1/20 | 0.42 |
| ▸ | CCNA2 | P20248 | 6/20 | 0.41 |
| ▸ | CDK2 | P24941 | 6/20 | 0.41 |
| ▸ | CDK9 | P50750 | 5/20 | 0.41 |
| ▸ | CCNK | O75909 | 4/20 | 0.41 |
| ▸ | CCND3 | P30281 | 3/20 | 0.41 |
| ▸ | CDK6 | Q00534 | 3/20 | 0.41 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | BCL6 | P41182 | 1/20 | 0.38 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.37 |
| ▸ | CDK7 | P50613 | 1/20 | 0.36 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.36 |
| ▸ | MAPK10 | P53779 | 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 | |
|---|---|---|---|---|
| SCHEMBL30223473 | 0.87 | CCNA2 (0.44) | LRRK2ULK1CCNA2CDK2CDK9 | |
| SCHEMBL24073506 | 0.87 | CCNA2 (0.44) | LRRK2ULK1CCNA2CDK2CDK9 | |
| SCHEMBL16204249 | 0.82 | CDK9 (0.41) | LRRK2ULK1CCNA2CDK2CDK9 | |
| SCHEMBL24716303 | 0.82 | KMT2A (0.44) | LRRK2ULK1CCNA2CDK2CDK9 | |
| SCHEMBL19557729 | 0.81 | MAPK8 (0.42) | LRRK2ULK1CCNA2CDK2CDK9 | |
| SCHEMBL17879578 | 0.80 | CDK9 (0.39) | LRRK2ULK1CCNA2CDK2CDK9 | |
| SCHEMBL2062564 | 0.79 | IGF1R (0.54) | LRRK2ULK1CCNA2CDK2CDK9 | |
| SCHEMBL19557698 | 0.78 | CCNA2 (0.38) | LRRK2ULK1CCNA2CDK2CDK9 | |
| SCHEMBL17879582 | 0.78 | CDK9 (0.38) | LRRK2ULK1CCNA2CDK2CDK9 | |
| SCHEMBL30394901 | 0.78 | CCNA2 (0.63) | LRRK2CCNA2CDK2CDK9CCNK |
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 |