Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 2/20 | 0.50 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.39 |
| ▸ | TYR | P14679 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | G6PD | P11413 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4060913 | 0.82 | TYR (0.42) | ESR2ALDH1A1HPGDHSD17B10TYR | |
| SCHEMBL3188020 | 0.81 | BACE1 (0.52) | BACE1ESR2ALOX5ALDH1A1HPGD | |
| SCHEMBL5612635 | 0.80 | ALDH1A1 (0.45) | ESR2ALDH1A1HPGDHSD17B10TYR | |
| SCHEMBL12922916 | 0.78 | HSD17B1 (0.41) | BACE1ESR2ALOX5ALDH1A1HPGD | |
| SCHEMBL4279291 | 0.77 | BACE1 (0.68) | BACE1ESR2ALOX5ALDH1A1HPGD | |
| SCHEMBL9615467 | 0.76 | LMNA (0.49) | ALDH1A1HSD17B10TYRHSP90AA1ALOX15 | |
| SCHEMBL3186998 | 0.76 | BACE1 (0.46) | BACE1ESR2ALOX5ALDH1A1HPGD | |
| SCHEMBL9817075 | 0.76 | BACE1 (0.46) | BACE1ESR2ALOX5ALDH1A1HPGD | |
| SCHEMBL9817023 | 0.75 | BACE1 (0.42) | BACE1ESR2ALDH1A1HPGDHSD17B10 | |
| SCHEMBL4274407 | 0.75 | BACE1 (0.73) | BACE1ESR2ALOX5ALDH1A1HPGD |
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-106458817-B | Novel bis (hydroxyalkoxyphenyl) diphenylmethanes | 本州化学工业株式会社 | 2021-03-16 | — | — | CN | disclosed |