Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL363585 | 0.91 | GPBAR1 (0.45) | GPBAR1SMN1; SMN2BRD4EPHX2 | |
| SCHEMBL364071 | 0.88 | GPBAR1 (0.47) | GPBAR1BRD4EPHX2 | |
| SCHEMBL364032 | 0.87 | GPBAR1 (0.47) | GPBAR1MAPTSMN1; SMN2BRD4ALDH1A1 | |
| SCHEMBL362350 | 0.84 | GPBAR1 (0.48) | GPBAR1MAPTCYP3A4CYP2D6SMN1; SMN2 | |
| SCHEMBL363032 | 0.84 | GPBAR1 (0.45) | GPBAR1BRD4EPHX2 | |
| SCHEMBL369862 | 0.83 | GPBAR1 (0.44) | GPBAR1MAPTCYP3A4CYP2C19CYP2D6 | |
| SCHEMBL1389662 | 0.83 | GPBAR1 (0.44) | GPBAR1MAPTCYP3A4CYP2C19CYP2D6 | |
| SCHEMBL363542 | 0.83 | GPBAR1 (0.47) | GPBAR1MAPTSMN1; SMN2BRD4ALDH1A1 | |
| SCHEMBL364239 | 0.83 | GPBAR1 (0.47) | GPBAR1MAPTSMN1; SMN2BRD4ALDH1A1 | |
| SCHEMBL362902 | 0.81 | GPBAR1 (0.45) | GPBAR1MAPTBRD4ALDH1A1KDM4E |
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 4 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 | claimed |
| WO-2012007365-A1 | 1-HYDROXYIMINO-3-PHENYL-PROPANES | F. HOFFMANN-LA ROCHE AG (CH) | 2012-01-19 | — | — | WO | claimed |
| 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 |