Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Menadione. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.75 |
| ▸ | MAPT | P10636 | 5/20 | 0.75 |
| ▸ | CDC25A | P30304 | 4/20 | 0.75 |
| ▸ | CDC25B | P30305 | 4/20 | 0.75 |
| ▸ | HPGD | P15428 | 4/20 | 0.75 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.75 |
| ▸ | IDO1 | P14902 | 3/20 | 0.75 |
| ▸ | MEN1 | O00255 | 3/20 | 0.75 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.75 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.75 |
| ▸ | LMNA | P02545 | 3/20 | 0.75 |
| ▸ | TP53 | P04637 | 2/20 | 0.75 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.75 |
| ▸ | HSPD1 | P10809 | 2/20 | 0.75 |
| ▸ | BLM | P54132 | 2/20 | 0.75 |
| ▸ | HSPE1 | P61604 | 2/20 | 0.75 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.75 |
| ▸ | TST | Q16762 | 2/20 | 0.75 |
| ▸ | GAA | P10253 | 2/20 | 0.75 |
| ▸ | ATM | Q13315 | 2/20 | 0.75 |
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 | |
|---|---|---|---|---|
| Menadione SCHEMBL5689015 | 0.91 | ALDH1A1 (0.84) | ALDH1A1MAPTCDC25ACDC25BHPGD | |
| Menadione SCHEMBL28229328 | 0.91 | ALDH1A1 (0.84) | ALDH1A1MAPTCDC25ACDC25BHPGD | |
| Menadione SCHEMBL27354760 | 0.89 | ALDH1A1 (0.81) | ALDH1A1MAPTCDC25ACDC25BHPGD | |
| Menadione SCHEMBL25970 | 0.87 | MAPT (1.00) | ALDH1A1MAPTCDC25ACDC25BHPGD | |
| Menadione SCHEMBL29351164 | 0.87 | MAPT (1.00) | ALDH1A1MAPTCDC25ACDC25BHPGD | |
| Menadione SCHEMBL1364028 | 0.87 | MAPT (1.00) | ALDH1A1MAPTCDC25ACDC25BHPGD | |
| Menadione SCHEMBL19356853 | 0.87 | MAPT (1.00) | ALDH1A1MAPTCDC25ACDC25BHPGD | |
| Menadione SCHEMBL9807661 | 0.85 | MAPT (0.95) | ALDH1A1MAPTCDC25ACDC25BHPGD | |
| Menadione SCHEMBL9812440 | 0.85 | MAPT (0.95) | ALDH1A1MAPTCDC25ACDC25BHPGD | |
| Menadione SCHEMBL9163371 | 0.85 | MAPT (0.95) | ALDH1A1MAPTCDC25ACDC25BHPGD |
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-105037125-A | Method for preparing vitamin K3 | COMPREHENSIVE TECHNOLOGY SERVICE CT OF QUANZHOU ENTRY EXIT INSPECTION & QUARANTINE BUREAU OF P R C | 2015-11-11 | — | — | CN | disclosed |