Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | MRGPRX1 | Q96LB2 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.40 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.40 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | GGT1 | P19440 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6357865 | 0.82 | HTT (0.53) | ALOX15ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL3647611 | 0.79 | ALOX15 (0.62) | ALOX15ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL104892 | 0.78 | IRAK4 (0.70) | IRAK4ALOX15ALDH1A1KDM4EHPGD | |
| SCHEMBL30625923 | 0.77 | IRAK4 (0.54) | IRAK4ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL27747076 | 0.77 | IRAK4 (0.54) | IRAK4ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL3636037 | 0.77 | IRAK4 (0.54) | IRAK4ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL1818841 | 0.77 | IRAK4 (0.54) | IRAK4ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL10763308 | 0.76 | IRAK4 (0.68) | IRAK4ALOX15ALDH1A1KDM4EHPGD | |
| Bicarbonate SCHEMBL21811920 | 0.76 | IRAK4 (0.68) | IRAK4ALOX15ALDH1A1KDM4EHPGD | |
| Bicarbonate SCHEMBL29943521 | 0.76 | IRAK4 (0.68) | IRAK4ALOX15ALDH1A1KDM4EHPGD |
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-1844045-A1 | PHENYL METHANONE DERIVATIVES AND THEIR USE AS GLYCINE TRANSPORTER 1 INHIBITORS | F.HOFFMANN-LA ROCHE AG (CH) | 2007-10-17 | — | — | EP | disclosed |
| WO-2006079467-A1 | PHENYL METHANONE DERIVATIVES AND THEIR USE AS GLYCINE TRANSPORTER 1 INHIBITORS | F. HOFMANN-LA ROCHE AG (CH) | 2006-08-03 | — | — | WO | disclosed |