Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK1 | P49759 | 6/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | GSK3B | P49841 | 2/20 | 0.43 |
| ▸ | WNT1 | P04628 | 1/20 | 0.43 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | PDE2A | O00408 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | KIT | P10721 | 5/20 | 0.42 |
| ▸ | AHR | P35869 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | CDK1 | P06493 | 1/20 | 0.40 |
| ▸ | CSF1R | P07333 | 1/20 | 0.40 |
| ▸ | PRKACA | P17612 | 1/20 | 0.40 |
| ▸ | FLT1 | P17948 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29062372 | 1.00 | CLK1 (0.52) | CLK1MAPK1ALDH1A1MAPTGSK3B | |
| SCHEMBL30569991 | 1.00 | CLK1 (0.52) | CLK1MAPK1ALDH1A1MAPTGSK3B | |
| SCHEMBL29020165 | 0.91 | CLK1 (0.52) | CLK1MAPK1THRBPDE2AKIT | |
| SCHEMBL29961629 | 0.91 | CLK1 (0.52) | CLK1MAPK1THRBPDE2AKIT | |
| SCHEMBL29020160 | 0.91 | CLK1 (0.52) | CLK1MAPK1THRBPDE2AKIT | |
| SCHEMBL29020182 | 0.90 | CLK1 (0.49) | CLK1MAPK1GSK3BWNT1DYRK1A | |
| SCHEMBL29020210 | 0.88 | CLK1 (0.48) | CLK1MAPK1KITAHRROCK2 | |
| SCHEMBL29961667 | 0.87 | CLK1 (0.50) | CLK1MAPK1PDE2AKITAHR | |
| SCHEMBL29020156 | 0.87 | CLK1 (0.50) | CLK1MAPK1PDE2AKITAHR | |
| SCHEMBL29020159 | 0.87 | CLK1 (0.50) | CLK1MAPK1PDE2AKITAHR |
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 |