Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 12/20 | 0.45 |
| ▸ | MGAM | O43451 | 11/20 | 0.45 |
| ▸ | SI | P14410 | 11/20 | 0.45 |
| ▸ | MGAM2 | Q2M2H8 | 11/20 | 0.45 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14894610 | 0.97 | GPBAR1 (0.52) | GPBAR1GAAMGAMSIMGAM2 | |
| SCHEMBL14896301 | 0.93 | BRD4 (0.48) | GPBAR1GAAMGAMSIMGAM2 | |
| SCHEMBL364841 | 0.88 | GAA (0.43) | GPBAR1GAAMGAMSIMGAM2 | |
| SCHEMBL363678 | 0.87 | GPBAR1 (0.61) | GPBAR1GAAMGAMSIMGAM2 | |
| SCHEMBL364664 | 0.87 | GAA (0.42) | GPBAR1GAAMGAMSIMGAM2 | |
| Hydroxyamine SCHEMBL363012 | 0.86 | GAA (0.41) | GPBAR1GAAMGAMSIMGAM2 | |
| SCHEMBL364331 | 0.86 | MGAM (0.43) | GPBAR1GAAMGAMSIMGAM2 | |
| SCHEMBL364728 | 0.85 | BRD4 (0.42) | GPBAR1GAAMGAMSIMGAM2 | |
| SCHEMBL364601 | 0.84 | GPBAR1 (0.66) | GPBAR1GAAMGAMSIMGAM2 | |
| SCHEMBL363349 | 0.84 | GPBAR1 (0.66) | GPBAR1GAAMGAMSIMGAM2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2593426-A1 | 1-HYDROXYIMINO-3-PHENYL-PROPANES | F.HOFFMANN-LA ROCHE AG (CH) | 2013-05-22 | — | — | EP | disclosed |
| WO-2012007365-A1 | 1-HYDROXYIMINO-3-PHENYL-PROPANES | F. HOFFMANN-LA ROCHE AG (CH) | 2012-01-19 | — | — | WO | disclosed |