Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.36 |
| ▸ | PRF1 | P14222 | 2/20 | 0.35 |
| ▸ | MAOA | P21397 | 2/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | PDE5A | O76074 | 1/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | PDE1A | P54750 | 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 | |
|---|---|---|---|---|
| SCHEMBL29580988 | 1.00 | GAA (0.49) | GAALMNAMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL30496989 | 0.78 | KDM4E (0.39) | GAALMNAMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL286550 | 0.78 | KDM4E (0.39) | GAALMNAMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL25214071 | 0.74 | PRF1 (0.39) | GAAKDM4ESMN1; SMN2PRF1MAOA | |
| SCHEMBL29450111 | 0.74 | PRF1 (0.39) | GAAKDM4ESMN1; SMN2PRF1MAOA | |
| SCHEMBL286734 | 0.74 | KDM4E (0.36) | GAALMNAMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL286714 | 0.73 | KDM4E (0.36) | GAALMNAMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL15191613 | 0.73 | KCNJ1 (0.37) | GAALMNAMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL855947 | 0.71 | MAOB (0.47) | GAALMNAMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL2729231 | 0.70 | KCNJ1 (0.36) | GAAMAPTKDM4ESMN1; SMN2MAOA |
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-114315805-A | Aromatic ring-fused cyclic lactone thiohydantoin compound and preparation method and application thereof | 中国科学院上海药物研究所 | 2022-04-12 | — | — | CN | disclosed |