Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.50 |
| ▸ | CA4 | P22748 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA6 | P23280 | 2/20 | 0.36 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | PDE5A | O76074 | 3/20 | 0.32 |
| ▸ | PDE4A | P27815 | 3/20 | 0.32 |
| ▸ | PDE1A | P54750 | 3/20 | 0.32 |
| ▸ | PDE1B | Q01064 | 3/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3739184 | 0.88 | CA2 (0.55) | CA2CA4KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL20123248 | 0.85 | KDM4E (0.47) | CA2CA4KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL13894663 | 0.80 | KDM4E (0.45) | CA2CA4KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL5424752 | 0.79 | KDM4E (0.52) | CA2CA4KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL13894572 | 0.78 | KDM4E (0.42) | CA2CA4KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL1507161 | 0.76 | KDM4E (0.58) | CA2CA4KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL21906404 | 0.75 | KDM4E (0.70) | CA2CA4KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL29850315 | 0.75 | KDM4E (0.70) | CA2CA4KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL3677552 | 0.75 | KDM4E (0.52) | CA2CA4KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL13079429 | 0.74 | KDM4E (0.50) | CA2CA4KDM4EALDH1A1SMN1; SMN2 |
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 |