Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APEX1 | P27695 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.35 |
| ▸ | DRD3 | P35462 | 6/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | PRNP | P04156 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 2/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.32 |
| ▸ | CD274 | Q9NZQ7 | 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 | |
|---|---|---|---|---|
| SCHEMBL3751277 | 0.92 | APEX1 (0.50) | APEX1ALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL3751273 | 0.92 | APEX1 (0.50) | APEX1ALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL13894545 | 0.88 | APEX1 (0.53) | APEX1ALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL13894723 | 0.84 | SLC2A1 (0.35) | APEX1ALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL13894727 | 0.81 | APEX1 (0.42) | APEX1ALDH1A1SMN1; SMN2KDM4ECYP1A2 | |
| SCHEMBL13894630 | 0.76 | KDM4E (0.37) | ALDH1A1SMN1; SMN2KDM4ECYP1A2CYP2C9 | |
| SCHEMBL3751108 | 0.75 | DRD2 (0.42) | MAPTDRD2 | |
| SCHEMBL13894719 | 0.75 | TDP1 (0.50) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL13894559 | 0.74 | KDM4E (0.35) | ALDH1A1SMN1; SMN2KDM4ECYP1A2CYP2C9 | |
| SCHEMBL13894722 | 0.74 | KDM4E (0.37) | ALDH1A1SMN1; SMN2KDM4ECYP1A2CYP2C9 |
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-2203161-B1 | QUINONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF | UNIV INDIANA RES & TECH CORP (US) | 2018-05-09 | — | — | EP | disclosed |