Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 6/20 | 0.42 |
| ▸ | PDE3A | Q14432 | 6/20 | 0.42 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA3 | P07451 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | CA6 | P23280 | 1/20 | 0.41 |
| ▸ | CA5A | P35218 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.41 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.41 |
| ▸ | ABL1 | P00519 | 2/20 | 0.41 |
| ▸ | EGFR | P00533 | 2/20 | 0.41 |
| ▸ | HCK | P08631 | 2/20 | 0.41 |
| ▸ | SRC | P12931 | 2/20 | 0.41 |
| ▸ | KDR | P35968 | 2/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4282655 | 0.88 | CA12 (0.47) | PDE3BPDE3ACA12CA9CA1 | |
| SCHEMBL9231553 | 0.77 | CA12 (0.49) | PDE3BPDE3ACA12CA9CA1 | |
| SCHEMBL20667106 | 0.72 | ADORA2A (0.52) | PDE3BPDE3ACA12CA9CA1 | |
| SCHEMBL4552802 | 0.72 | CA12 (0.57) | CA12CA9CA1CA3CA4 | |
| SCHEMBL15638389 | 0.72 | F11 (0.49) | PDE3BPDE3APIK3CDABL1EGFR | |
| SCHEMBL20658700 | 0.72 | NPC1 (0.61) | PIK3CDABL1EGFRHCKSRC | |
| SCHEMBL15345000 | 0.71 | CA12 (0.59) | PDE3BPDE3ACA12CA9CA1 | |
| SCHEMBL13680450 | 0.70 | CA12 (0.53) | PDE3BPDE3ACA12CA9CA1 | |
| SCHEMBL4287747 | 0.69 | PDE3B (0.57) | PDE3BPDE3ACA12CA9CA1 | |
| SCHEMBL176039 | 0.69 | KDM4E (0.68) | ULK1CDK7CDK5PRKCECAMK2G |
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 |
|---|---|---|---|---|---|---|---|
| CN-111163780-A | Heterocyclic compounds as adenosine antagonists | 诺维逊生物股份有限公司 | 2020-05-15 | — | — | CN | disclosed |