Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPAS1 | Q99814 | 14/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | ACLY | P53396 | 1/20 | 0.45 |
| ▸ | VEGFA | P15692 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.40 |
| ▸ | ESPL1 | Q14674 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6869892 | 0.86 | EPAS1 (0.54) | EPAS1ALDH1A1ESPL1SLC22A12 | |
| SCHEMBL15867026 | 0.82 | ACLY (0.49) | EPAS1ACLYVEGFAHSP90AA1HSP90AB1 | |
| SCHEMBL2789258 | 0.81 | ALDH1A1 (0.64) | EPAS1ALDH1A1ESPL1 | |
| SCHEMBL319459 | 0.79 | ACLY (0.47) | EPAS1ACLYVEGFAHSP90AA1HSP90AB1 | |
| SCHEMBL12327372 | 0.79 | EPAS1 (0.55) | EPAS1ACLYHSP90AA1HSP90AB1SLC22A12 | |
| SCHEMBL1497199 | 0.79 | CA2 (0.52) | ALDH1A1ACLYHSP90AA1HSP90AB1 | |
| SCHEMBL27080946 | 0.78 | SLC22A12 (0.44) | EPAS1ACLYHSP90AA1HSP90AB1SLC22A12 | |
| Hydrochloric Acid SCHEMBL28228241 | 0.77 | ACLY (0.46) | EPAS1ALDH1A1ACLYVEGFAHSP90AA1 | |
| SCHEMBL2789621 | 0.76 | EPAS1 (0.46) | EPAS1ALDH1A1 | |
| SCHEMBL3246788 | 0.76 | GABRA2 (0.45) | EPAS1ACLYHSP90AA1HSP90AB1SLC22A12 |
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-105530923-A | Aryl ethers and their use | PELOTON THERAPEUTICS INC | 2016-04-27 | — | — | CN | disclosed |