Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 8/20 | 0.77 |
| ▸ | CES2 | O00748 | 7/20 | 0.77 |
| ▸ | GAPDH | P04406 | 4/20 | 0.75 |
| ▸ | IDO1 | P14902 | 1/20 | 0.69 |
| ▸ | CDC25A | P30304 | 1/20 | 0.69 |
| ▸ | CDC25B | P30305 | 1/20 | 0.69 |
| ▸ | P4HB | P07237 | 1/20 | 0.65 |
| ▸ | MEN1 | O00255 | 1/20 | 0.59 |
| ▸ | NSD2 | O96028 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.59 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL9628251 | 1.00 | CES1 (0.77) | CES1CES2GAPDHIDO1CDC25A | |
| SCHEMBL17594909 | 0.91 | GAPDH (0.89) | CES1CES2GAPDHIDO1CDC25A | |
| SCHEMBL9849815 | 0.87 | CES2 (0.77) | CES1CES2GAPDHIDO1CDC25A | |
| SCHEMBL4468407 | 0.86 | GAPDH (1.00) | CES1CES2GAPDHIDO1CDC25A | |
| SCHEMBL9628238 | 0.86 | GAPDH (0.69) | CES1CES2GAPDHIDO1CDC25A | |
| SCHEMBL17594484 | 0.83 | GAPDH (0.75) | CES1CES2GAPDHIDO1CDC25A | |
| SCHEMBL9628376 | 0.83 | CES1 (0.77) | CES1CES2GAPDHIDO1CDC25A | |
| SCHEMBL28916510 | 0.83 | GAPDH (0.75) | CES1CES2GAPDHIDO1CDC25A | |
| SCHEMBL19420523 | 0.83 | GAPDH (0.69) | CES1CES2GAPDHIDO1CDC25A | |
| SCHEMBL30704447 | 0.82 | GAPDH (0.63) | CES1CES2GAPDHIDO1CDC25A |
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-4232439-A1 | 5-HYDROXY-1,4-NAPHTHALENEDIONE FOR USE IN THE TREATMENT OF CANCER | Godavari Biorefineries Ltd. (IN) | 2023-08-30 | — | — | EP | disclosed |
| WO-2022091123-A1 | 5-HYDROXY-1,4-NAPHTHALENEDIONE FOR USE IN THE TREATMENT OF CANCER | GODAVARI BIOREFINERIES LIMITED (IN) | 2022-05-05 | — | — | WO | disclosed |