Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.46 |
| ▸ | CES1 | P23141 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | JAK1 | P23458 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | F2 | P00734 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28478142 | 0.82 | CES2 (0.55) | CES2CES1SMN1; SMN2KDM4EHPGD | |
| SCHEMBL25387866 | 0.77 | PTGS2 (0.35) | CES2CES1SMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL30648242 | 0.75 | CES2 (0.54) | CES2CES1SMN1; SMN2KDM4EHPGD | |
| SCHEMBL30648236 | 0.75 | CES2 (0.54) | CES2CES1SMN1; SMN2KDM4EHPGD | |
| SCHEMBL30648237 | 0.75 | CES2 (0.54) | CES2CES1SMN1; SMN2KDM4EHPGD | |
| SCHEMBL11300618 | 0.75 | CES2 (0.54) | CES2CES1SMN1; SMN2KDM4EHPGD | |
| SCHEMBL28510347 | 0.74 | SMN1; SMN2 (0.39) | SMN1; SMN2KDM4EHPGDALDH1A1EGFR | |
| SCHEMBL2208486 | 0.72 | CES2 (0.50) | CES2CES1SMN1; SMN2KDM4EHPGD | |
| SCHEMBL17025091 | 0.71 | PARP1 (0.43) | SMN1; SMN2KDM4EHPGDALDH1A1MEN1 | |
| SCHEMBL29961790 | 0.71 | PARP1 (0.43) | SMN1; SMN2KDM4EHPGDALDH1A1MEN1 |
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-112441981-B | 1,2, 5-polysubstituted imidazole derivative and synthesis method and application thereof | 平顶山学院 | 2021-12-03 | — | — | CN | disclosed |
| CN-112441981-A | 1,2, 5-polysubstituted imidazole derivative and synthesis method and application thereof | 平顶山学院 | 2021-03-05 | — | — | CN | disclosed |