Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK1 | P49759 | 6/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.41 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.39 |
| ▸ | KIT | P10721 | 4/20 | 0.38 |
| ▸ | IDH1 | O75874 | 1/20 | 0.38 |
| ▸ | CLK2 | P49760 | 1/20 | 0.37 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.37 |
| ▸ | AHR | P35869 | 1/20 | 0.37 |
| ▸ | WNT1 | P04628 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29020182 | 0.89 | CLK1 (0.49) | CLK1MAPK1KITCLK2LRRK2 | |
| SCHEMBL29020210 | 0.87 | CLK1 (0.48) | CLK1MAPK1KITCLK2LRRK2 | |
| SCHEMBL29062372 | 0.86 | CLK1 (0.52) | CLK1MAPK1KITAHRWNT1 | |
| SCHEMBL30569991 | 0.86 | CLK1 (0.52) | CLK1MAPK1KITAHRWNT1 | |
| SCHEMBL29020140 | 0.86 | CLK1 (0.52) | CLK1MAPK1KITAHRWNT1 | |
| SCHEMBL29961651 | 0.85 | CLK1 (0.46) | CLK1MAPK1 | |
| SCHEMBL29020176 | 0.85 | CLK1 (0.46) | CLK1MAPK1 | |
| SCHEMBL29961629 | 0.85 | CLK1 (0.52) | CLK1MAPK1KITAHRRAB9A | |
| SCHEMBL29020160 | 0.85 | CLK1 (0.52) | CLK1MAPK1KITAHRRAB9A | |
| SCHEMBL29020165 | 0.85 | CLK1 (0.52) | CLK1MAPK1KITAHRRAB9A |
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-115093400-B | AhR inhibitor, application and preparation method thereof | 北京华森英诺生物科技有限公司 | 2023-09-05 | — | — | CN | disclosed |
| CN-115093400-A | AhR inhibitor and application and preparation method thereof | 重庆华森制药股份有限公司 | 2022-09-23 | — | — | CN | disclosed |