Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.50 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.50 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.50 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.44 |
| ▸ | CTSD | P07339 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | GABBR2 | O75899 | 3/20 | 0.41 |
| ▸ | GABBR1 | Q9UBS5 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9015372 | 0.82 | HDAC4 (0.68) | LMNAKDM4EALDH1A1MAPTL3MBTL1 | |
| SCHEMBL27887015 | 0.80 | HDAC4 (0.50) | LMNAKDM4EALDH1A1MAPTL3MBTL1 | |
| SCHEMBL28938769 | 0.80 | ALDH1A1 (0.50) | ALDH1A1HDAC4HDAC7HDAC5CTSD | |
| SCHEMBL28261641 | 0.80 | KEAP1 (0.50) | LMNAKDM4EALDH1A1MAPTCTSD | |
| SCHEMBL2978269 | 0.79 | CTSD (0.67) | LMNAALDH1A1MAPTHDAC4HDAC7 | |
| SCHEMBL20168851 | 0.79 | CTSD (0.67) | LMNAALDH1A1MAPTHDAC4HDAC7 | |
| SCHEMBL6766263 | 0.79 | CTSD (0.67) | LMNAALDH1A1MAPTHDAC4HDAC7 | |
| SCHEMBL11871960 | 0.78 | HDAC4 (0.48) | LMNAKDM4EALDH1A1MAPTL3MBTL1 | |
| SCHEMBL27828567 | 0.78 | HDAC4 (0.48) | LMNAKDM4EALDH1A1MAPTL3MBTL1 | |
| SCHEMBL9059059 | 0.77 | FFAR2 (0.50) | ALDH1A1HDAC4HDAC7HDAC5FFAR2 |
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-108997253-B | Mandelic acid derivatives containing 1,3, 4-oxadiazole thioether and application thereof | 贵州大学 | 2022-05-24 | — | — | CN | disclosed |
| WO-1996017840-A1 | HETEROCYCLYL SUBSTITUTED HYDROXYACETAMIDE DERIVATIVES AS FONGICIDES | AGREVO UK LIMITED (GB) | 1996-06-13 | — | — | WO | disclosed |