Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.67 |
| ▸ | GAA | P10253 | 3/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.62 |
| ▸ | NPC1 | O15118 | 2/20 | 0.62 |
| ▸ | HTT | P42858 | 1/20 | 0.62 |
| ▸ | RAB9A | P51151 | 1/20 | 0.62 |
| ▸ | HSD11B1 | P28845 | 7/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | TSHR | P16473 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.56 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.56 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.56 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.56 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.56 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.56 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.56 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.56 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.56 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL9375839 | 0.88 | PDE4B (0.57) | MAPTGAASMN1; SMN2NPC1HTT | |
| SCHEMBL2499200 | 0.87 | MAPT (0.60) | MAPTGAASMN1; SMN2NPC1HTT | |
| SCHEMBL5376658 | 0.81 | MAPT (0.69) | MAPTGAASMN1; SMN2HSD11B1ALDH1A1 | |
| SCHEMBL7115361 | 0.81 | MAPT (0.54) | MAPTGAASMN1; SMN2NPC1HTT | |
| SCHEMBL7637081 | 0.80 | RAB9A (0.68) | MAPTSMN1; SMN2NPC1HTTRAB9A | |
| SCHEMBL24451279 | 0.80 | MAPT (0.68) | MAPTGAASMN1; SMN2HSD11B1ALDH1A1 | |
| SCHEMBL28507824 | 0.79 | HSD11B1 (0.60) | MAPTSMN1; SMN2NPC1HTTRAB9A | |
| SCHEMBL15988928 | 0.78 | CTNNB1 (0.77) | MAPTGAASMN1; SMN2NPC1RAB9A | |
| SCHEMBL29668496 | 0.78 | MEN1 (0.71) | MAPTGAASMN1; SMN2NPC1RAB9A | |
| SCHEMBL12349836 | 0.78 | MAPT (0.66) | MAPTGAASMN1; SMN2HSD11B1ALDH1A1 |
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-112174793-B | Method and ligand for breaking C-S bond of alpha-thioaryl ethanone compound | 温州大学 | 2023-03-28 | — | — | CN | disclosed |
| CN-112174793-A | Method and ligand for breaking C-S bond of alpha-thioaryl ethanone compound | 温州大学 | 2021-01-05 | — | — | CN | disclosed |