Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 10/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | MAPT | P10636 | 5/20 | 0.46 |
| ▸ | HPGD | P15428 | 4/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | HBB | P68871 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | RAD52 | P43351 | 1/20 | 0.38 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.38 |
| ▸ | DHFR | P00374 | 2/20 | 0.36 |
| ▸ | ELANE | P08246 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29232886 | 0.91 | KDM4E (0.40) | KDM4EALDH1A1MAPTHPGDHSD17B10 | |
| SCHEMBL29232887 | 0.91 | KDM4E (0.40) | KDM4EALDH1A1MAPTHPGDHSD17B10 | |
| SCHEMBL29232882 | 0.83 | KDM4E (0.35) | KDM4EALDH1A1MAPTHPGDHSD17B10 | |
| SCHEMBL29232900 | 0.82 | KDM4E (0.47) | KDM4EALDH1A1MAPTHPGDHSD17B10 | |
| SCHEMBL29232881 | 0.81 | MAPT (0.52) | MAPTMEN1KMT2AMAPK1HTT | |
| SCHEMBL29232911 | 0.74 | TP53 (0.39) | KDM4EALDH1A1HPGDHSD17B10TDP1 | |
| SCHEMBL29232915 | 0.74 | TP53 (0.39) | KDM4EALDH1A1MAPTHPGDHSD17B10 | |
| SCHEMBL29232906 | 0.74 | ELANE (0.49) | ALDH1A1MAPTMEN1KMT2AMAPK1 | |
| SCHEMBL3782966 | 0.71 | KDM4E (0.49) | KDM4EALDH1A1MAPTHPGDHSD17B10 | |
| SCHEMBL29232884 | 0.70 | KDM4E (0.37) | KDM4EALDH1A1MAPTHPGDHSD17B10 |
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 |