Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | CTSA | P10619 | 16/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL15949005 | 0.86 | GPBAR1 (0.49) | GPBAR1HDAC4CTSA | |
| SCHEMBL364576 | 0.85 | GPBAR1 (0.55) | GPBAR1HDAC4CTSA | |
| SCHEMBL1389816 | 0.85 | GPBAR1 (0.55) | GPBAR1HDAC4CTSA | |
| SCHEMBL1389813 | 0.85 | GPBAR1 (0.55) | GPBAR1HDAC4CTSA | |
| SCHEMBL15949094 | 0.83 | GPBAR1 (0.62) | GPBAR1HDAC4CTSA | |
| SCHEMBL15949092 | 0.83 | GPBAR1 (0.62) | GPBAR1HDAC4CTSA | |
| SCHEMBL1390101 | 0.82 | MGAM (0.47) | GPBAR1CTSA | |
| SCHEMBL364364 | 0.76 | GPBAR1 (0.63) | GPBAR1CTSA | |
| SCHEMBL364172 | 0.74 | GPBAR1 (0.56) | GPBAR1CTSA | |
| SCHEMBL1390286 | 0.74 | GPBAR1 (0.56) | GPBAR1CTSA |
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-2593426-B1 | 1-HYDROXYIMINO-3-PHENYL-PROPANES | HOFFMANN LA ROCHE (CH) | 2014-08-20 | — | — | EP | claimed |