Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 5/20 | 0.67 |
| ▸ | MAOB | P27338 | 4/20 | 0.67 |
| ▸ | IDO1 | P14902 | 1/20 | 0.67 |
| ▸ | CDC25B | P30305 | 1/20 | 0.67 |
| ▸ | AKT1 | P31749 | 1/20 | 0.67 |
| ▸ | SNCA | P37840 | 1/20 | 0.67 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.67 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.67 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.67 |
| ▸ | NSD1 | Q96L73 | 1/20 | 0.67 |
| ▸ | EHMT1 | Q9H9B1 | 1/20 | 0.67 |
| ▸ | LTA4H | P09960 | 3/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | GAPDH | P04406 | 2/20 | 0.57 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.52 |
| ▸ | CES2 | O00748 | 1/20 | 0.52 |
| ▸ | CES1 | P23141 | 1/20 | 0.52 |
| ▸ | NSD2 | O96028 | 1/20 | 0.48 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.48 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Naphthoquinone SCHEMBL27489572 | 0.84 | CDC25B (0.93) | MAOAMAOBIDO1CDC25BAKT1 | |
| Naphthoquinone SCHEMBL27587031 | 0.82 | CDC25B (0.88) | MAOAMAOBIDO1CDC25BAKT1 | |
| Naphthoquinone SCHEMBL42139 | 0.82 | IDO1 (1.00) | MAOAMAOBIDO1CDC25BAKT1 | |
| Naphthoquinone SCHEMBL8861335 | 0.82 | IDO1 (1.00) | MAOAMAOBIDO1CDC25BAKT1 | |
| Naphthoquinone SCHEMBL29354680 | 0.82 | IDO1 (1.00) | MAOAMAOBIDO1CDC25BAKT1 | |
| Naphthoquinone SCHEMBL11359780 | 0.82 | IDO1 (1.00) | MAOAMAOBIDO1CDC25BAKT1 | |
| Anthraquinone SCHEMBL3750915 | 0.80 | NSD2 (0.58) | MAOAMAOBIDO1CDC25BAKT1 | |
| Anthraquinone SCHEMBL28596353 | 0.80 | MEN1 (0.63) | MAOAMAOBCDC25BLTA4HTSHR | |
| SCHEMBL6432470 | 0.80 | LTA4H (0.55) | MAOAMAOBIDO1CDC25BAKT1 | |
| Naphthoquinone SCHEMBL722080 | 0.79 | IDO1 (0.93) | MAOAMAOBIDO1CDC25BAKT1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117510338-A | Natural naphthoquinone derivative and preparation method and application thereof | 贵州大学 | 2024-02-06 | — | — | CN | claimed |
| CN-117510338-A | Natural naphthoquinone derivative and preparation method and application thereof | 贵州大学 | 2024-02-06 | — | — | CN | disclosed |
| CN-117510338-A | Natural naphthoquinone derivative and preparation method and application thereof | 贵州大学 | 2024-02-06 | — | — | CN | disclosed |