Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC25B | P30305 | 3/20 | 0.50 |
| ▸ | IDO1 | P14902 | 3/20 | 0.50 |
| ▸ | CDC25A | P30304 | 2/20 | 0.50 |
| ▸ | GAPDH | P04406 | 1/20 | 0.47 |
| ▸ | PTPRC | P08575 | 2/20 | 0.41 |
| ▸ | CES2 | O00748 | 2/20 | 0.40 |
| ▸ | CES1 | P23141 | 2/20 | 0.40 |
| ▸ | S100A4 | P26447 | 3/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 2/20 | 0.39 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30749483 | 1.00 | CDC25B (0.50) | CDC25BIDO1CDC25AGAPDHPTPRC | |
| SCHEMBL29209336 | 0.78 | GAPDH (0.57) | CDC25BIDO1CDC25AGAPDHPTPRC | |
| SCHEMBL30749478 | 0.78 | GAPDH (0.57) | CDC25BIDO1CDC25AGAPDHPTPRC | |
| SCHEMBL29209320 | 0.73 | S100A4 (0.56) | CDC25BIDO1CDC25AGAPDHCES2 | |
| SCHEMBL30749476 | 0.73 | S100A4 (0.56) | CDC25BIDO1CDC25AGAPDHCES2 | |
| SCHEMBL29209306 | 0.73 | KMT2A (0.51) | CDC25BIDO1CDC25AGAPDHPTPRC | |
| SCHEMBL30749485 | 0.73 | KMT2A (0.51) | CDC25BIDO1CDC25AGAPDHPTPRC | |
| SCHEMBL196710 | 0.70 | TDP1 (0.52) | MEN1LMNAKMT2AHTR6F2 | |
| SCHEMBL30217935 | 0.70 | TDP1 (0.52) | MEN1LMNAKMT2AHTR6F2 | |
| SCHEMBL7092323 | 0.69 | KMT2A (0.48) | CDC25BIDO1CDC25ACES2CES1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117510338-A | Natural naphthoquinone derivative and preparation method and application thereof | 贵州大学 | 2024-02-06 | — | — | CN | disclosed |