Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.31 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.31 |
| ▸ | RXRA | P19793 | 1/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | XDH | P47989 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5249047 | 0.80 | LMNA (0.38) | CYP1A2CYP2C19CYP2D6HPGDALDH1A1 | |
| SCHEMBL5246016 | 0.79 | CYP1A2 (0.35) | L3MBTL1CYP1A2CYP2C19CYP2D6HPGD | |
| SCHEMBL5246028 | 0.78 | CYP1A2 (0.34) | L3MBTL1CYP1A2CYP2C19CYP2D6HPGD | |
| SCHEMBL5248524 | 0.78 | LMNA (0.43) | CYP1A2CYP2C19CYP2D6RECQLLMNA | |
| SCHEMBL3112551 | 0.78 | XDH (0.45) | L3MBTL1CYP1A2CYP2C19CYP2D6HPGD | |
| SCHEMBL5248039 | 0.77 | EPHX2 (0.51) | L3MBTL1CYP1A2CYP2C19CYP2D6HPGD | |
| SCHEMBL5246363 | 0.77 | KDM4E (0.33) | L3MBTL1ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL3114145 | 0.77 | CYP1A2 (0.42) | CYP1A2CYP2C19CYP2D6HPGDALDH1A1 | |
| SCHEMBL5250067 | 0.77 | P2RX7 (0.39) | CYP1A2CYP2C19HPGDALDH1A1CYP2C9 | |
| Hydrochloric Acid SCHEMBL3117772 | 0.77 | RAB9A (0.41) | L3MBTL1CYP1A2CYP2C19CYP2D6HPGD |
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-1867331-A1 | TRIAZOLE DERIVATIVE AND THE USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2007-12-19 | — | — | EP | disclosed |