Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 3/20 | 0.37 |
| ▸ | SLC6A9 | P48067 | 5/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | SLC6A5 | Q9Y345 | 2/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.32 |
| ▸ | ULK1 | O75385 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL365164 | 0.91 | GPBAR1 (0.37) | GPBAR1MAPK1ADORA2AADORA2B | |
| SCHEMBL363619 | 0.84 | GPBAR1 (0.39) | GPBAR1SLC6A9EPHX2MAPK14SLC6A5 | |
| SCHEMBL1390044 | 0.82 | GPBAR1 (0.39) | GPBAR1SLC6A9MAPK14SLC6A5MMP1 | |
| SCHEMBL1390040 | 0.82 | GPBAR1 (0.39) | GPBAR1SLC6A9MAPK14SLC6A5MMP1 | |
| SCHEMBL15949103 | 0.80 | GPBAR1 (0.35) | GPBAR1 | |
| SCHEMBL15949003 | 0.77 | GPBAR1 (0.48) | GPBAR1 | |
| SCHEMBL363976 | 0.76 | GPBAR1 (0.41) | GPBAR1SLC6A9EPHX2MAPK14SLC6A5 | |
| SCHEMBL15949284 | 0.75 | GPBAR1 (0.60) | GPBAR1 | |
| SCHEMBL1390253 | 0.75 | GPBAR1 (0.41) | GPBAR1SLC6A9SLC6A5MMP1 | |
| SCHEMBL1390250 | 0.75 | GPBAR1 (0.41) | GPBAR1SLC6A9SLC6A5MMP1 |
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 | disclosed |