Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.38 |
| ▸ | TDO2 | P48775 | 2/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 2/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6254410 | 0.77 | IDO1 (0.40) | IDO1TDO2CYP3A4CNR2SLC6A2 | |
| SCHEMBL2717119 | 0.77 | CES2 (0.40) | CES2CES1CYP3A4MEN1ALDH1A1 | |
| SCHEMBL20228717 | 0.76 | CYP3A4 (0.38) | IDO1TDO2CES2CES1CYP3A4 | |
| SCHEMBL29966788 | 0.76 | CES2 (0.42) | IDO1TDO2CES2CES1CYP3A4 | |
| SCHEMBL18921341 | 0.76 | CES2 (0.42) | IDO1TDO2CES2CES1CYP3A4 | |
| SCHEMBL6258732 | 0.75 | MC4R (0.41) | IDO1TDO2CES2CES1CYP3A4 | |
| SCHEMBL18921518 | 0.73 | CES2 (0.40) | IDO1TDO2CES2CES1CYP3A4 | |
| SCHEMBL7299070 | 0.72 | CYP19A1 (0.43) | IDO1TDO2CES2CES1CYP3A4 | |
| SCHEMBL28420951 | 0.72 | IDO1 (0.45) | IDO1TDO2CNR2SLC6A2SLC6A4 | |
| SCHEMBL2194908 | 0.72 | CYP3A4 (0.41) | IDO1TDO2CES2CES1CYP3A4 |
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-112689636-B | Novel heteroatom aromatic amide derivative and pharmaceutical agent containing same | 科研制药株式会社 | 2024-08-20 | — | — | CN | disclosed |