Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CTSL | P07711 | 1/20 | 0.33 |
| ▸ | CTSB | P07858 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
| ▸ | USP30 | Q70CQ3 | 5/20 | 0.32 |
| ▸ | ITGB3 | P05106 | 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 | |
|---|---|---|---|---|
| SCHEMBL4793567 | 1.00 | CYP2D6 (0.44) | CYP2D6TDP1TP53KDM4EALDH1A1 | |
| SCHEMBL31420630 | 0.81 | CYP2D6 (0.44) | CYP2D6MAPTMAPK1ITGB3ITGA2B | |
| SCHEMBL856649 | 0.81 | CYP2D6 (0.44) | CYP2D6MAPTMAPK1ITGB3ITGA2B | |
| SCHEMBL2697931 | 0.78 | TSHR (0.46) | CYP2D6TP53KDM4EALDH1A1L3MBTL1 | |
| SCHEMBL2722545 | 0.77 | EPHX2 (0.47) | CYP2D6KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL5795748 | 0.77 | CYP2D6 (0.45) | CYP2D6TDP1KDM4EMEN1KMT2A | |
| SCHEMBL22777599 | 0.74 | CYP2D6 (0.55) | CYP2D6TDP1KDM4EALDH1A1BRD4 | |
| SCHEMBL16494745 | 0.74 | CYP2D6 (0.50) | CYP2D6TDP1MAPTBRD4EPHX1 | |
| SCHEMBL25051622 | 0.74 | CYP2D6 (0.50) | CYP2D6KDM4EALDH1A1KMT2AEPHX1 | |
| SCHEMBL3679199 | 0.74 | KCNH2 (0.40) | CYP2D6TP53MEN1KMT2A |
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-1992628-A1 | Derivatives and analogs of N-ethylquinolones and N-ethylazaquinolones | GLAXO GROUP LIMITED (GB) | 2008-11-19 | — | — | EP | disclosed |