Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.35 |
| ▸ | AHR | P35869 | 1/20 | 0.34 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.33 |
| ▸ | NQO2 | P16083 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | TDO2 | P48775 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.31 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.31 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.31 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.31 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.31 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.31 |
| ▸ | APP | P05067 | 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 | |
|---|---|---|---|---|
| SCHEMBL26426000 | 1.00 | PTGS1 (0.37) | PTGS1NFE2L2AHREPAS1NQO2 | |
| SCHEMBL26426007 | 0.92 | PTGS1 (0.47) | PTGS1NFE2L2AHRNQO2HDAC3 | |
| SCHEMBL26425430 | 0.92 | NFE2L2 (0.39) | PTGS1NFE2L2AHREPAS1ALDH1A1 | |
| SCHEMBL26425426 | 0.91 | NFE2L2 (0.47) | NFE2L2 | |
| SCHEMBL26425423 | 0.86 | CYP1A1 (0.42) | NFE2L2EPAS1ALDH1A1 | |
| SCHEMBL26425412 | 0.84 | AHR (0.43) | NFE2L2AHREPAS1ALDH1A1 | |
| SCHEMBL26425434 | 0.84 | NFE2L2 (0.40) | PTGS1NFE2L2ALDH1A1 | |
| SCHEMBL17969016 | 0.84 | NFE2L2 (0.45) | NFE2L2ALDH1A1 | |
| SCHEMBL16398906 | 0.84 | NFE2L2 (0.45) | NFE2L2ALDH1A1 | |
| SCHEMBL24254424 | 0.84 | MAPT (0.39) | EPAS1ALDH1A1 |
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-111333672-B | Sterol regulatory element binding protein and acidic nucleoplasm DNA binding protein-1 inhibitor, and preparation method and application thereof | 中国医学科学院放射医学研究所 | 2022-11-08 | — | — | CN | disclosed |