Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.39 |
| ▸ | CDK1 | P06493 | 1/20 | 0.39 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.39 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.39 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.39 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | PDE3B | Q13370 | 3/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.32 |
| ▸ | MAP4K1 | Q92918 | 2/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.31 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL23443031 | 0.85 | ALDH1A1 (0.50) | ALDH1A1CDK5BRD4MEN1HTT | |
| SCHEMBL26126300 | 0.80 | ALDH1A1 (0.42) | ALDH1A1CCNB2CDK1CCNB1CDK5 | |
| SCHEMBL13154922 | 0.80 | CCNB2 (0.57) | ALDH1A1CCNB2CDK1CCNB1CDK5 | |
| SCHEMBL31526668 | 0.77 | CDK5 (0.44) | ALDH1A1CCNB2CDK1CCNB1CDK5 | |
| SCHEMBL24323747 | 0.77 | ALDH1A1 (0.42) | ALDH1A1CCNB2CDK1CCNB1CDK5 | |
| SCHEMBL30588641 | 0.77 | ALDH1A1 (0.42) | ALDH1A1CCNB2CDK1CCNB1CDK5 | |
| SCHEMBL30588731 | 0.75 | ALDH1A1 (0.38) | ALDH1A1CCNB2CDK1CCNB1CDK5 | |
| SCHEMBL26123090 | 0.75 | ALDH1A1 (0.38) | ALDH1A1CCNB2CDK1CCNB1CDK5 | |
| SCHEMBL12437101 | 0.74 | CCNB2 (0.37) | CCNB2CDK1CCNB1CDK5CDK5R1 | |
| SCHEMBL17090692 | 0.74 | ADORA2A (0.38) | ALDH1A1CCNB2CDK1CCNB1CDK5 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020073011-A1 | COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH APJ RECEPTOR ACTIVITY | ANNAPURNA BIO, INC. (US) | 2020-04-09 | — | — | WO | disclosed |