Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 2/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.37 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
| ▸ | LCK | P06239 | 1/20 | 0.34 |
| ▸ | ITK | Q08881 | 1/20 | 0.34 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.34 |
| ▸ | OXTR | P30559 | 1/20 | 0.34 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL20401267 | 1.00 | CDK1 (0.40) | CDK1PIM1ADORA2AADORA2BADORA1 | |
| SCHEMBL20417203 | 1.00 | CDK1 (0.40) | CDK1PIM1ADORA2AADORA2BADORA1 | |
| SCHEMBL20416750 | 1.00 | CDK1 (0.40) | CDK1PIM1ADORA2AADORA2BADORA1 | |
| SCHEMBL30402199 | 0.97 | ADORA2A (0.37) | CDK1PIM1ADORA2AADORA2BADORA1 | |
| SCHEMBL20400921 | 0.97 | ADORA2A (0.37) | CDK1PIM1ADORA2AADORA2BADORA1 | |
| SCHEMBL30401183 | 0.94 | ADORA2A (0.36) | ADORA2AADORA2BADORA1HDAC6HDAC2 | |
| SCHEMBL20400402 | 0.94 | ADORA2A (0.36) | ADORA2AADORA2BADORA1HDAC6HDAC2 | |
| SCHEMBL20417202 | 0.93 | ADORA2A (0.36) | ADORA2AADORA2BADORA1HDAC6HDAC2 | |
| SCHEMBL20436656 | 0.91 | CDK1 (0.43) | CDK1PIM1ADORA2AADORA2BADORA1 | |
| SCHEMBL20416879 | 0.89 | PDE1B (0.39) | ADORA2AADORA2BADORA1HDAC6HDAC2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116768859-A | Azolopyrimidines for the treatment of cancer related disorders | 艾库斯生物科学有限公司 | 2023-09-19 | — | — | CN | disclosed |
| CN-110214012-B | Azolopyrimidines for the treatment of cancer related disorders | 艾库斯生物科学有限公司 | 2023-05-09 | — | — | CN | disclosed |