Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSTP1 | P09211 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.33 |
| ▸ | LTA4H | P09960 | 2/20 | 0.33 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.31 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 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 | |
|---|---|---|---|---|
| SCHEMBL24074881 | 0.89 | HTR2B (0.36) | PTGS2BRD4HTR1AHTR7HTR2B | |
| SCHEMBL24075519 | 0.88 | CYP3A4 (0.39) | CYP3A4CYP2C9HTR1AHTR7MEN1 | |
| SCHEMBL24075598 | 0.86 | CYP3A4 (0.38) | CYP3A4CYP2C9MEN1KMT2A | |
| SCHEMBL24075599 | 0.85 | BRD4 (0.45) | GSTP1BRD4MEN1KMT2A | |
| SCHEMBL24075521 | 0.84 | HCRTR1 (0.39) | FFAR1FFAR4ALDH1A1SCN9AMEN1 | |
| SCHEMBL24074898 | 0.84 | BRD4 (0.42) | BRD4ALDH1A1HTTMEN1KMT2A | |
| SCHEMBL24075601 | 0.84 | GRM2 (0.40) | LMNAMEN1KMT2ACYP19A1 | |
| SCHEMBL24075600 | 0.83 | EDNRB (0.32) | ALDH1A1MEN1KMT2A | |
| SCHEMBL24075819 | 0.82 | EDNRB (0.34) | MEN1KMT2A | |
| SCHEMBL24075665 | 0.82 | PTGS2 (0.34) | PTGS2ALDH1A1HTR1AHTR7 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021238588-A1 | OXATHIAZINE COMPOUND AND USE THEREOF | 四川大学华西医院 | 2021-12-02 | — | — | WO | disclosed |