Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | P4HB | P07237 | 1/20 | 0.45 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA3 | P07451 | 2/20 | 0.43 |
| ▸ | CA6 | P23280 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | TYR | P14679 | 1/20 | 0.43 |
| ▸ | DRD1 | P21728 | 1/20 | 0.43 |
| ▸ | CA4 | P22748 | 1/20 | 0.43 |
| ▸ | CA5A | P35218 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA5B | Q9Y2D0 | 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 | |
|---|---|---|---|---|
| Hydroquinone SCHEMBL7626940 | 0.90 | ALDH1A1 (0.59) | ALDH1A1L3MBTL1MAPTRAB9AHTT | |
| Hydroquinone SCHEMBL8024416 | 0.90 | ALDH1A1 (0.59) | ALDH1A1L3MBTL1MAPTRAB9AHTT | |
| SCHEMBL5090338 | 0.87 | MMP2 (0.50) | ALDH1A1L3MBTL1MAPTHTTFFAR1 | |
| SCHEMBL1489146 | 0.84 | ALDH1A1 (0.67) | ALDH1A1L3MBTL1MAPTRAB9AHTT | |
| Hydroquinone SCHEMBL29072909 | 0.83 | NR4A2 (0.60) | ALDH1A1L3MBTL1MAPTRAB9AHTT | |
| Hydrochloric Acid SCHEMBL711176 | 0.82 | ALDH1A1 (0.65) | ALDH1A1L3MBTL1MAPTRAB9AHTT | |
| Benzene SCHEMBL28158854 | 0.82 | ALDH1A1 (0.65) | ALDH1A1L3MBTL1MAPTRAB9AHTT | |
| SCHEMBL28781661 | 0.81 | PARP10 (0.63) | ALDH1A1MAPTRAB9AP4HBCA12 | |
| SCHEMBL2831629 | 0.81 | MAPT (0.49) | ALDH1A1MAPTRAB9ANPC1POLB | |
| SCHEMBL2364296 | 0.81 | MAPT (0.49) | ALDH1A1MAPTRAB9ANPC1POLB |
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-114853577-A | Method for preparing dimethyl ether and co-producing p-hydroxybenzonitrile | 三门峡环宇生化科技有限公司 | 2022-08-05 | — | — | CN | disclosed |