Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 3/20 | 0.48 |
| ▸ | PNP | P00491 | 5/20 | 0.38 |
| ▸ | HPRT1 | P00492 | 4/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.37 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.37 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
| ▸ | ADCY5 | O95622 | 1/20 | 0.37 |
| ▸ | TK1 | P04183 | 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 | |
|---|---|---|---|---|
| SCHEMBL19553535 | 0.83 | ADORA2A (0.53) | ADORA2AHPRT1CDK1CCNB1CCNE1 | |
| SCHEMBL14145054 | 0.81 | ADORA2A (0.58) | ADORA2ACDK1CCNB1CCNE1CDK2 | |
| SCHEMBL4572145 | 0.78 | ADORA2A (0.56) | ADORA2ACDK1CCNB1CCNE1CDK2 | |
| SCHEMBL14145481 | 0.75 | CDK1 (0.45) | ADORA2ACDK1CCNB1CCNE1CDK2 | |
| SCHEMBL14401041 | 0.75 | CDK1 (0.65) | ADORA2ACDK1CCNB1CCNE1CDK2 | |
| SCHEMBL179439 | 0.72 | PI4KA (0.57) | ADORA2ACDK1CCNB1CCNE1CDK2 | |
| SCHEMBL9563504 | 0.71 | ADORA2A (0.83) | ADORA2AADCY5 | |
| SCHEMBL12417531 | 0.70 | CDK1 (0.58) | ADORA2ACDK1CCNB1CCNE1CDK2 | |
| SCHEMBL19575557 | 0.69 | CDK1 (0.50) | ADORA2APNPHPRT1CDK1ADCY5 | |
| SCHEMBL19553651 | 0.67 | TK1 (0.49) | ADORA2ACDK1CCNB1CCNE1CDK2 |
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-3452477-B1 | ADENINE DERIVATIVES AS PROTEIN KINASE INHIBITORS | B C I PHARMA (BE) | 2023-09-13 | — | — | EP | disclosed |