Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | STAT3 | P40763 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | GLA | P06280 | 2/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | IKBKB | O14920 | 1/20 | 0.41 |
| ▸ | MGAM | O43451 | 2/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | HSD17B14 | Q9BPX1 | 1/20 | 0.37 |
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3841616 | 0.86 | ALDH1A1 (0.47) | ALDH1A1KDM4EHPGDGAASTAT3 | |
| SCHEMBL6535899 | 0.86 | KDM4E (0.51) | ALDH1A1KDM4EHPGDGAASTAT3 | |
| SCHEMBL30288437 | 0.82 | KDM4E (0.51) | ALDH1A1KDM4EHPGDGAASTAT3 | |
| SCHEMBL2422281 | 0.82 | ALDH1A1 (0.47) | ALDH1A1KDM4EHPGDGAASTAT3 | |
| SCHEMBL8630313 | 0.82 | KDM4E (0.51) | ALDH1A1KDM4EHPGDGAASTAT3 | |
| SCHEMBL60874 | 0.81 | ALDH1A1 (0.61) | ALDH1A1KDM4EHPGDGAASTAT3 | |
| SCHEMBL2975427 | 0.80 | KDM4E (0.56) | ALDH1A1KDM4EHPGDGAASTAT3 | |
| SCHEMBL3515481 | 0.80 | IKBKB (0.54) | ALDH1A1KDM4EHPGDGAASTAT3 | |
| SCHEMBL31220555 | 0.80 | TDP1 (0.51) | ALDH1A1KDM4EHPGDGAASTAT3 | |
| SCHEMBL27616064 | 0.79 | ALDH1A1 (0.51) | ALDH1A1KDM4EHPGDGAASTAT3 |
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-110790761-B | Metal small molecule complex material grafted with hydroxyquinoline imide and preparation method and application thereof | 华南理工大学 | 2022-07-26 | — | — | CN | claimed |