Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.45 |
| ▸ | DHODH | Q02127 | 1/20 | 0.34 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | CASP2 | P42575 | 1/20 | 0.32 |
| ▸ | TRPV3 | Q8NET8 | 3/20 | 0.31 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.31 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | ESRRB | O95718 | 1/20 | 0.30 |
| ▸ | ESR1 | P03372 | 1/20 | 0.30 |
| ▸ | ESRRA | P11474 | 1/20 | 0.30 |
| ▸ | ESRRG | P62508 | 1/20 | 0.30 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.30 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.30 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.30 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.30 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.30 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21820204 | 1.00 | HDAC1 (0.45) | HDAC1HDAC6DHODHSCN5ASCN9A | |
| SCHEMBL30366038 | 0.86 | HDAC1 (0.43) | HDAC1HDAC6DHODHSCN5ASCN9A | |
| SCHEMBL20582331 | 0.86 | HDAC1 (0.43) | HDAC1HDAC6DHODHSCN5ASCN9A | |
| SCHEMBL20582330 | 0.86 | HDAC1 (0.44) | HDAC1HDAC6DHODHSCN5ASCN9A | |
| SCHEMBL30366412 | 0.86 | HDAC1 (0.44) | HDAC1HDAC6DHODHSCN5ASCN9A | |
| SCHEMBL21820342 | 0.85 | HDAC1 (0.43) | HDAC1HDAC6DHODHSCN5ASCN9A | |
| SCHEMBL30366308 | 0.85 | HDAC1 (0.43) | HDAC1HDAC6DHODHSCN5ASCN9A | |
| SCHEMBL20582419 | 0.85 | HDAC1 (0.40) | HDAC1HDAC6SCN5ASCN9A | |
| SCHEMBL30366161 | 0.85 | HDAC1 (0.40) | HDAC1HDAC6SCN5ASCN9A | |
| SCHEMBL28980748 | 0.83 | CASP2 (0.33) | CASP2 |
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-110382505-B | Heterocyclic compounds useful as antibacterial agents and process for producing the same | 巴格沃克斯研究有限公司 | 2023-04-04 | — | — | CN | disclosed |