Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.34 |
| ▸ | BRD4 | O60885 | 6/20 | 0.33 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.32 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | IRAK4 | Q9NWZ3 | 6/20 | 0.31 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.31 |
| ▸ | KDR | P35968 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25117955 | 1.00 | ADORA3 (0.34) | ADORA3ADORA2ABRD4KLKB1CCNA2 | |
| SCHEMBL25117792 | 0.92 | JAK2 (0.35) | ADORA3ADORA2ABRD4PCSK9ADORA1 | |
| SCHEMBL25117959 | 0.89 | CCNA2 (0.37) | ADORA3ADORA2ACCNA2CDK2PCSK9 | |
| SCHEMBL25117961 | 0.89 | CCNA2 (0.37) | ADORA3ADORA2ACCNA2CDK2PCSK9 | |
| SCHEMBL25118102 | 0.84 | JAK2 (0.37) | ADORA3ADORA2ABRD4IRAK4PCSK9 | |
| SCHEMBL25117936 | 0.83 | CCNA2 (0.39) | CCNA2CDK2TP53POLB | |
| SCHEMBL25117793 | 0.82 | JAK2 (0.35) | ADORA3ADORA2ABRD4CCNA2CDK2 | |
| SCHEMBL25117922 | 0.81 | JAK2 (0.36) | ADORA3ADORA2ACCNA2CDK2TP53 | |
| SCHEMBL25117920 | 0.81 | JAK2 (0.36) | ADORA3ADORA2ACCNA2CDK2TP53 | |
| SCHEMBL25839388 | 0.81 | JAK2 (0.35) | ADORA3ADORA2ABRD4IRAK4ADORA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4163283-A1 | COMPOUND HAVING MACROCYCLIC STRUCTURE AND USE THEREOF | Scinnohub Pharmaceutical Co., Ltd (CN) | 2023-04-12 | — | — | EP | disclosed |