Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 6/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.39 |
| ▸ | NSD2 | O96028 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 5/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.38 |
| ▸ | GAA | P10253 | 4/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 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 | |
|---|---|---|---|---|
| SCHEMBL23930705 | 1.00 | HTT (0.42) | HTTKDM4EALDH1A1MAPK1NSD2 | |
| SCHEMBL29212920 | 0.82 | HTT (0.39) | HTTKDM4EALDH1A1MAPK1NSD2 | |
| SCHEMBL21367479 | 0.82 | KDM4E (0.39) | HTTKDM4EALDH1A1MAPK1NSD2 | |
| SCHEMBL29472262 | 0.82 | KDM4E (0.59) | HTTKDM4EALDH1A1MAPK1NSD2 | |
| SCHEMBL14998245 | 0.82 | KDM4E (0.46) | HTTKDM4EALDH1A1MAPK1HPGD | |
| SCHEMBL22289639 | 0.82 | KDM4E (0.59) | HTTKDM4EALDH1A1MAPK1NSD2 | |
| SCHEMBL3587374 | 0.79 | KDM4E (0.42) | HTTKDM4EALDH1A1MAPK1NSD2 | |
| SCHEMBL14250219 | 0.78 | HTT (0.67) | HTTKDM4EALDH1A1MAPK1GLA | |
| SCHEMBL15893191 | 0.74 | MAPK1 (0.40) | HTTKDM4EALDH1A1MAPK1NSD2 | |
| SCHEMBL2824003 | 0.73 | IDH1 (0.37) | KDM4EALDH1A1MAPK1HPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115667244-B | 3-azabicycloalkyl derivatives and pharmaceutical compositions containing the same | 株式会社LG化学 | 2024-04-12 | — | — | CN | disclosed |
| CN-115667244-A | 3-azabicycloalkyl derivatives and pharmaceutical compositions comprising the same | 株式会社LG化学 | 2023-01-31 | — | — | CN | disclosed |