Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.37 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.37 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
| ▸ | EPAS1 | Q99814 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | TTR | P02766 | 1/20 | 0.36 |
| ▸ | PPOX | P50336 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28848323 | 0.83 | TSHR (0.38) | ALDH1A1CYP1A2CYP2D6CYP2C19TSHR | |
| SCHEMBL450176 | 0.81 | ALDH1A1 (0.51) | ALDH1A1CYP1A2CYP2D6CYP2C19TSHR | |
| SCHEMBL10631372 | 0.80 | ALDH1A1 (0.54) | ALDH1A1CYP1A2CYP2D6CYP2C19TSHR | |
| SCHEMBL10628873 | 0.80 | ALDH1A1 (0.54) | ALDH1A1CYP1A2CYP2D6CYP2C19TSHR | |
| SCHEMBL2612651 | 0.80 | TSHR (0.53) | ALDH1A1TSHRTDP1CYP3A4HPGD | |
| SCHEMBL30855346 | 0.80 | TSHR (0.53) | ALDH1A1TSHRTDP1CYP3A4HPGD | |
| SCHEMBL10986975 | 0.79 | TSHR (0.53) | ALDH1A1CYP1A2CYP2C19TSHRTDP1 | |
| SCHEMBL9550142 | 0.79 | TSHR (0.45) | ALDH1A1CYP1A2CYP2C19TSHRNOTUM | |
| SCHEMBL27621308 | 0.77 | TDP1 (0.39) | ALDH1A1CYP1A2CYP2D6CYP2C19TSHR | |
| SCHEMBL7012924 | 0.75 | ALDH1A1 (0.51) | ALDH1A1CYP1A2CYP2D6CYP2C19TSHR |
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-114957235-B | Benzothiazinone derivatives, preparation method and application thereof | 四川大学华西医院 | 2023-10-24 | — | — | CN | disclosed |
| CN-114957235-A | Benzothiazinone derivative and preparation method and application thereof | 四川大学华西医院 | 2022-08-30 | — | — | CN | disclosed |