Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.59 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.59 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.59 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.59 |
| ▸ | HTR2A | P28223 | 1/20 | 0.59 |
| ▸ | HTR2C | P28335 | 1/20 | 0.59 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.59 |
| ▸ | HRH1 | P35367 | 1/20 | 0.59 |
| ▸ | DRD3 | P35462 | 1/20 | 0.59 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.59 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.59 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.43 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.43 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.43 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.43 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28269038 | 0.88 | MAPK1 (0.52) | SLC6A3CHRM1AKR1A1CHRM3HTR2A | |
| SCHEMBL16760961 | 0.84 | CHRM3 (0.53) | SLC6A3CHRM1AKR1A1CHRM3HTR2A | |
| SCHEMBL23886177 | 0.83 | MAPK1 (0.48) | SLC6A3CHRM1AKR1A1CHRM3HTR2A | |
| SCHEMBL23886180 | 0.83 | MAPK1 (0.48) | SLC6A3CHRM1AKR1A1CHRM3HTR2A | |
| Valproic Acid SCHEMBL140241 | 0.77 | CHRM1 (1.00) | SLC6A3CHRM1AKR1A1CHRM3HTR2A | |
| Valproic Acid SCHEMBL2275 | 0.77 | CHRM1 (1.00) | SLC6A3CHRM1AKR1A1CHRM3HTR2A | |
| Valproic Acid SCHEMBL1330837 | 0.77 | CHRM1 (1.00) | SLC6A3CHRM1AKR1A1CHRM3HTR2A | |
| 2-Ethylhexanoic Acid SCHEMBL18037731 | 0.75 | CA2 (0.62) | SMN1; SMN2GRIK1SLC1A3SLC1A2SLC1A1 | |
| 2-Ethylhexanoic Acid SCHEMBL25281401 | 0.75 | CA2 (0.62) | SMN1; SMN2SLC1A3SLC1A2SLC1A1ALDH1A1 | |
| Valproic Acid SCHEMBL2184648 | 0.75 | CHRM1 (0.94) | SLC6A3CHRM1AKR1A1CHRM3HTR2A |
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-113651745-A | Buvalracetam intermediate, preparation method and purification method thereof | 上海医药工业研究院 | 2021-11-16 | — | — | CN | disclosed |