Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 6/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 5/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | OXTR | P30559 | 1/20 | 0.35 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.35 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20400402 | 1.00 | ADORA2A (0.36) | ADORA2AADORA2BADORA1HDAC2HDAC8 | |
| SCHEMBL20417202 | 0.99 | ADORA2A (0.36) | ADORA2AADORA2BADORA1HDAC2HDAC8 | |
| SCHEMBL30402199 | 0.97 | ADORA2A (0.37) | ADORA2AADORA2BADORA1HDAC2HDAC8 | |
| SCHEMBL20400921 | 0.97 | ADORA2A (0.37) | ADORA2AADORA2BADORA1HDAC2HDAC8 | |
| SCHEMBL20417203 | 0.94 | CDK1 (0.40) | ADORA2AADORA2BADORA1HDAC2HDAC8 | |
| SCHEMBL20401267 | 0.94 | CDK1 (0.40) | ADORA2AADORA2BADORA1HDAC2HDAC8 | |
| SCHEMBL20416750 | 0.94 | CDK1 (0.40) | ADORA2AADORA2BADORA1HDAC2HDAC8 | |
| SCHEMBL30401965 | 0.94 | CDK1 (0.40) | ADORA2AADORA2BADORA1HDAC2HDAC8 | |
| SCHEMBL20436652 | 0.91 | ADORA2A (0.39) | ADORA2AADORA2BADORA1HDAC2HDAC8 | |
| SCHEMBL20416883 | 0.90 | PDE1B (0.39) | ADORA2AADORA2BADORA1HDAC2HDAC8 |
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 |