Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.37 |
| ▸ | ARSA | P15289 | 1/20 | 0.35 |
| ▸ | CDC25A | P30304 | 1/20 | 0.35 |
| ▸ | CDC25C | P30307 | 1/20 | 0.35 |
| ▸ | CYP1A1 | P04798 | 5/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.34 |
| ▸ | CYP1B1 | Q16678 | 5/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.33 |
| ▸ | NQO1 | P15559 | 1/20 | 0.33 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.33 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.33 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.33 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL26511888 | 0.90 | CYP3A4 (0.34) | CYP3A4CYP2C19TSHRABCG2ARSA | |
| SCHEMBL26501764 | 0.90 | CYP3A4 (0.36) | CYP3A4CYP2C19TSHRABCG2ARSA | |
| SCHEMBL26502545 | 0.88 | CYP3A4 (0.33) | CYP3A4CYP2C19TSHRABCG2ARSA | |
| SCHEMBL24735267 | 0.87 | ARSA (0.38) | CYP3A4CYP2C19TSHRABCG2ARSA | |
| SCHEMBL19774356 | 0.85 | ALOX5 (0.39) | CYP3A4CYP2C19ALOX5NQO1KDM4E | |
| SCHEMBL26520484 | 0.85 | ALOX5 (0.35) | CYP3A4CYP2C19TSHRABCG2CYP1A1 | |
| SCHEMBL22541942 | 0.83 | ARSA (0.42) | CYP3A4CYP2C19TSHRABCG2ARSA | |
| SCHEMBL26501997 | 0.82 | ABCG2 (0.39) | CYP3A4CYP2C19TSHRABCG2CYP1A1 | |
| SCHEMBL22541867 | 0.82 | L3MBTL1 (0.46) | CYP3A4CYP2C19TSHRABCG2ARSA | |
| SCHEMBL26511115 | 0.81 | ABCG2 (0.42) | CYP3A4CYP2C19TSHRABCG2CYP1A1 |
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-2021210305-A1 | ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE | 出光興産株式会社 | 2021-10-21 | — | — | WO | disclosed |