Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 4/20 | 0.53 |
| ▸ | NSD2 | O96028 | 1/20 | 0.41 |
| ▸ | MERTK | Q12866 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.40 |
| ▸ | IRAK4 | Q9NWZ3 | 3/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | TTK | P33981 | 1/20 | 0.37 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.36 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1227148 | 0.88 | MEN1 (0.47) | LRRK2MERTKPDE4BKDM4EPRKCQ | |
| SCHEMBL1226660 | 0.88 | LRRK2 (0.44) | LRRK2MERTKPDE4BKDM4EPRKCQ | |
| SCHEMBL25219740 | 0.81 | LRRK2 (0.41) | LRRK2MERTKIRAK4KDM4EPRKCQ | |
| SCHEMBL16822154 | 0.81 | MERTK (0.41) | LRRK2MERTKIRAK4KDM4EPRKCQ | |
| SCHEMBL16822121 | 0.81 | MERTK (0.41) | LRRK2MERTKIRAK4KDM4EPRKCQ | |
| SCHEMBL1227640 | 0.80 | MERTK (0.49) | LRRK2MERTKKDM4EPRKCQPRKCD | |
| SCHEMBL1227635 | 0.80 | MERTK (0.49) | LRRK2MERTKKDM4EPRKCQPRKCD | |
| SCHEMBL13625177 | 0.80 | MERTK (0.49) | LRRK2MERTKKDM4EPRKCQPRKCD | |
| SCHEMBL1227632 | 0.80 | MERTK (0.49) | LRRK2MERTKKDM4EPRKCQPRKCD | |
| SCHEMBL25276365 | 0.79 | NSD2 (0.40) | LRRK2NSD2MERTKMAPK1IRAK4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023091726-A1 | INHIBITORS OF CYCLIN‑DEPENDENT KINASE 12 (CDK12) | SYROS PHARMACEUTICALS, INC. (US) | 2023-05-25 | — | — | WO | disclosed |