Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.79 |
| ▸ | CYP1A2 | P05177 | 9/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.62 |
| ▸ | LMNA | P02545 | 1/20 | 0.62 |
| ▸ | CYP1A1 | P04798 | 7/20 | 0.56 |
| ▸ | CYP1B1 | Q16678 | 7/20 | 0.56 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.51 |
| ▸ | TYR | P14679 | 1/20 | 0.51 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | ERN1 | O75460 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL28451899 | 0.90 | ALDH1A1 (0.69) | ALDH1A1CYP1A2CYP2C19CYP2C9LMNA | |
| SCHEMBL96291 | 0.89 | ALDH1A1 (1.00) | ALDH1A1CYP1A2CYP2C19CYP2C9CYP1A1 | |
| SCHEMBL28360529 | 0.88 | ALDH1A1 (0.67) | ALDH1A1CYP1A2CYP2C19CYP2C9LMNA | |
| Hydrochloric Acid SCHEMBL9456784 | 0.87 | ALDH1A1 (0.96) | ALDH1A1CYP1A2CYP2C19CYP2C9CYP1A1 | |
| Ethylene SCHEMBL4914414 | 0.85 | ALDH1A1 (0.92) | ALDH1A1CYP1A2CYP2C19CYP2C9CYP1A1 | |
| Formaldehyde SCHEMBL28854145 | 0.85 | ALDH1A1 (0.92) | ALDH1A1CYP1A2CYP2C19CYP2C9CYP1A1 | |
| SCHEMBL21660344 | 0.83 | ALDH1A1 (0.59) | ALDH1A1CYP1A2CYP2C19CYP2C9LMNA | |
| SCHEMBL756641 | 0.81 | ALDH1A1 (0.51) | ALDH1A1CYP1A2CYP2C19CYP2C9LMNA | |
| SCHEMBL24068857 | 0.81 | TYR (0.80) | ALDH1A1CYP1A2CYP2C19CYP2C9LMNA | |
| SCHEMBL3181478 | 0.80 | ALDH1A1 (0.76) | ALDH1A1CYP1A2CYP2C19CYP2C9LMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021238587-A1 | MICROMOLECULAR OXATHIAZINE DERIVATIVE AND USE THEREOF | 四川大学华西医院 | 2021-12-02 | — | — | WO | disclosed |
| CN-111559990-B | Micromolecular oxathiazine derivative and application thereof | 四川大学华西医院 | 2021-03-09 | — | — | CN | disclosed |
| CN-111559990-A | Micromolecular oxathiazine derivative and application thereof | 四川大学华西医院 | 2020-08-21 | — | — | CN | disclosed |