Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC7 | O00311 | 1/20 | 0.46 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | MPO | P05164 | 2/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.32 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.32 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.32 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.32 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14844897 | 0.86 | MPO (0.44) | GRM5MPOALDH1A1HTT | |
| SCHEMBL16008737 | 0.83 | MAPK14 (0.47) | MAPK14HDAC1HDAC6MPOAR | |
| SCHEMBL30405703 | 0.82 | CYP2A6 (0.42) | ALDH1A1HTTCYP2C9PIK3CAPIK3CB | |
| SCHEMBL30605064 | 0.79 | MAPK14 (0.43) | MAPK14HDAC1HDAC6ARALDH1A1 | |
| SCHEMBL14764810 | 0.77 | LRRK2 (0.33) | HDAC1HDAC6MPO | |
| SCHEMBL18802950 | 0.76 | GRM5 (0.40) | GRM5ARALDH1A1HTT | |
| SCHEMBL25272227 | 0.73 | KDM4E (0.41) | MAPK14ARALDH1A1THRBHTT | |
| SCHEMBL29514377 | 0.71 | GRM5 (0.42) | MAPK14HDAC1HDAC6GRM5THRB | |
| SCHEMBL14844846 | 0.71 | PDE4A (0.38) | MAPK14GRM5MPOPIK3CA | |
| SCHEMBL29050045 | 0.71 | GRM5 (0.42) | MAPK14HDAC1HDAC6GRM5THRB |
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-116171280-A | Casein kinase 1 delta modulators | 詹森药业有限公司 | 2023-05-26 | — | — | CN | disclosed |