Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.37 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | SPR | P35270 | 1/20 | 0.33 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.33 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.32 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL24707424 | 1.00 | SLC6A2 (0.37) | SLC6A2SLC6A4HRH4HRH3RAD51 | |
| SCHEMBL30856775 | 0.84 | GRIN2D (0.47) | SLC6A2SLC6A4HRH4HRH3ACVR1 | |
| SCHEMBL24706831 | 0.84 | GRIN2D (0.47) | SLC6A2SLC6A4HRH4HRH3ACVR1 | |
| SCHEMBL901368 | 0.79 | ALDH1A1 (0.40) | KDM4EALDH1A1SMN1; SMN2ACACB | |
| SCHEMBL13063401 | 0.79 | CYP17A1 (0.48) | HRH3KDM4EALDH1A1 | |
| SCHEMBL12835924 | 0.77 | CRBN (0.49) | KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL24135526 | 0.77 | PARP1 (0.48) | ALDH1A1ROCK1MAP3K14CYP3A4CYP2C9 | |
| SCHEMBL31333194 | 0.76 | PARP1 (0.47) | ROCK1MAP3K14 | |
| SCHEMBL29187003 | 0.75 | MEN1 (0.36) | SLC6A2SLC6A4HRH4HRH3ACVR1 | |
| SCHEMBL15509065 | 0.74 | HRH4 (0.59) | HRH4HRH3HTTKDM4EALDH1A1 |
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-117813302-A | Substituted tetrahydrofuran-2-carboxamides as sodium channel modulators | 沃泰克斯药物股份有限公司 | 2024-04-02 | — | — | CN | disclosed |