Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH2 | P05091 | 15/20 | 0.73 |
| ▸ | MAOA | P21397 | 8/20 | 0.73 |
| ▸ | MAOB | P27338 | 8/20 | 0.73 |
| ▸ | XDH | P47989 | 1/20 | 0.70 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.66 |
| ▸ | MAPT | P10636 | 4/20 | 0.66 |
| ▸ | NPC1 | O15118 | 4/20 | 0.66 |
| ▸ | RAB9A | P51151 | 4/20 | 0.66 |
| ▸ | MEN1 | O00255 | 3/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.66 |
| ▸ | TSHR | P16473 | 2/20 | 0.66 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.66 |
| ▸ | LMNA | P02545 | 2/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.63 |
| ▸ | TP53 | P04637 | 3/20 | 0.63 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.63 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.63 |
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 | |
|---|---|---|---|---|
| SCHEMBL10338453 | 0.87 | KDM4E (0.80) | ALDH2MAOAMAOBXDHALDH1A1 | |
| SCHEMBL1701110 | 0.84 | ALDH2 (1.00) | ALDH2MAOAMAOBXDHALDH1A1 | |
| SCHEMBL16232228 | 0.84 | ALDH2 (0.73) | ALDH2MAOAMAOBXDHALDH1A1 | |
| Isoformonentin SCHEMBL73338 | 0.83 | XDH (1.00) | ALDH2MAOAMAOBXDHALDH1A1 | |
| Isoformonentin SCHEMBL30105310 | 0.83 | XDH (1.00) | ALDH2MAOAMAOBXDHALDH1A1 | |
| SCHEMBL16161066 | 0.82 | ALDH2 (0.64) | ALDH2MAOAMAOBXDH | |
| SCHEMBL16161112 | 0.81 | ALDH2 (0.66) | ALDH2MAOAMAOBXDHALDH1A1 | |
| SCHEMBL5497023 | 0.81 | ALDH2 (0.69) | ALDH2MAOAMAOBXDHALDH1A1 | |
| SCHEMBL5489200 | 0.81 | ALDH2 (0.69) | ALDH2MAOAMAOBXDHALDH1A1 | |
| Hydrochloric Acid SCHEMBL16161023 | 0.81 | ALDH2 (0.65) | ALDH2MAOAMAOBXDHALDH1A1 |
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-2789604-B1 | DAIDZEIN DERIVATIVE, PHARMACEUTICALLY ACCEPTABLE SALT AND PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME | ANHUI BIOCHEM BIO PHARMACEUTICAL CO LTD (CN) | 2020-02-12 | — | — | EP | disclosed |