Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.36 |
| ▸ | AURKA | O14965 | 1/20 | 0.36 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.36 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.36 |
| ▸ | GSK3A | P49840 | 1/20 | 0.36 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.36 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.36 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.34 |
| ▸ | BRPF1 | P55201 | 2/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29232900 | 0.84 | KDM4E (0.47) | KDM4ECHEK1AURKADAPK3CSNK1A1 | |
| SCHEMBL29232882 | 0.81 | KDM4E (0.35) | KDM4ECHEK1AURKADAPK3CSNK1A1 | |
| SCHEMBL29233022 | 0.80 | MAPT (0.50) | ALDH1A1MAPTMEN1KMT2APOLB | |
| SCHEMBL29232911 | 0.75 | TP53 (0.39) | KDM4EHPGDALDH1A1HSD17B10FGFR1 | |
| SCHEMBL29232915 | 0.73 | TP53 (0.39) | KDM4EHPGDALDH1A1HSD17B10MAPT | |
| SCHEMBL29232885 | 0.70 | NGFR (0.47) | CHEK1HPGDFGFR1GABRA1GABRG2 | |
| SCHEMBL29232897 | 0.70 | KDM4E (0.46) | KDM4EHPGDALDH1A1HSD17B10MAPT | |
| SCHEMBL29433546 | 0.69 | KDM4E (0.50) | KDM4EHPGDALDH1A1HSD17B10MAPT | |
| SCHEMBL351390 | 0.69 | KDM4E (0.50) | KDM4EHPGDALDH1A1HSD17B10MAPT | |
| SCHEMBL3782966 | 0.64 | KDM4E (0.49) | KDM4ECHEK1AURKADAPK3CSNK1A1 |
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-118206560-A | Lipoic acid derivative containing pyridazino indole structure, and preparation method and application thereof | 浙江中医药大学 | 2024-06-18 | — | — | CN | disclosed |