Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPAS1 | Q99814 | 15/20 | 0.46 |
| ▸ | VEGFA | P15692 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | SLC22A12 | Q96S37 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13082284 | 0.79 | CYP1A2 (0.44) | EPAS1CYP1A2CYP2C19SLC22A12 | |
| SCHEMBL2431935 | 0.77 | CYP1A2 (0.43) | CYP1A2CYP2C19 | |
| SCHEMBL4972108 | 0.77 | CYP1A2 (0.43) | EPAS1CYP1A2CYP2C19SLC22A12 | |
| SCHEMBL9965492 | 0.76 | HSD11B1 (0.47) | — | |
| SCHEMBL8663674 | 0.75 | HSD11B1 (0.37) | EPAS1CYP1A2CYP2C19 | |
| SCHEMBL5009144 | 0.75 | LMNA (0.42) | CYP1A2CYP2C19SLC22A12 | |
| SCHEMBL11095403 | 0.75 | ALDH1A1 (0.57) | CYP1A2CYP2C19SLC22A12 | |
| SCHEMBL13994213 | 0.72 | HSD11B1 (0.36) | CYP1A2CYP2C19SLC22A12 | |
| SCHEMBL4968453 | 0.72 | CYP1A2 (0.50) | CYP1A2CYP2C19SLC22A12 | |
| SCHEMBL30192879 | 0.72 | ALDH1A1 (0.53) | SLC22A12 |
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 |