Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 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 | |
|---|---|---|---|---|
| SCHEMBL2316311 | 1.00 | AKR1B1 (0.34) | AKR1B1MAOBESR1ESR2 | |
| SCHEMBL2317446 | 0.86 | NOTUM (0.37) | AKR1B1ESR1ESR2 | |
| SCHEMBL2317447 | 0.86 | NOTUM (0.37) | AKR1B1ESR1ESR2 | |
| SCHEMBL2317337 | 0.82 | MEN1 (0.31) | — | |
| SCHEMBL2317332 | 0.82 | MEN1 (0.31) | — | |
| SCHEMBL2314394 | 0.81 | APP (0.34) | MAOB | |
| SCHEMBL2314398 | 0.81 | APP (0.34) | MAOB | |
| SCHEMBL2316995 | 0.81 | ALDH1A1 (0.39) | AKR1B1MAOBESR1ESR2 | |
| SCHEMBL2316992 | 0.81 | ALDH1A1 (0.39) | AKR1B1MAOBESR1ESR2 | |
| SCHEMBL2315821 | 0.79 | KDM4E (0.39) | MAOB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1609786-B1 | 5-alkenone-3,3-dimethyl-benzoxepines derivatives useful for the preparation of antidiabetic pentadienoic acids | MERCK SANTE SAS (FR) | 2011-08-03 | — | — | EP | claimed |