Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.32 |
| ▸ | KDM5A | P29375 | 1/20 | 0.31 |
| ▸ | CLK1 | P49759 | 2/20 | 0.30 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.30 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.30 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.30 |
| ▸ | CLK2 | P49760 | 1/20 | 0.30 |
| ▸ | CLK3 | P49761 | 1/20 | 0.30 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.30 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.30 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21263268 | 0.75 | PARP1 (0.41) | DYRK1AGAA | |
| SCHEMBL15812731 | 0.74 | CSNK1A1 (0.33) | ADORA3KDM5A | |
| SCHEMBL15071082 | 0.72 | CSNK2A1 (0.39) | ADORA3 | |
| SCHEMBL15334774 | 0.67 | TSHR (0.44) | CYP11B1CYP11B2PRKCQPRKCD | |
| SCHEMBL11296434 | 0.67 | KDM4A (0.33) | — | |
| SCHEMBL27185599 | 0.67 | HSP90AA1 (0.41) | KDM5A | |
| SCHEMBL30951806 | 0.66 | PARP1 (0.43) | CLK1CDK5DYRK1ACDK5R1CLK4 | |
| SCHEMBL9615544 | 0.66 | ALDH1A1 (0.49) | GAA | |
| SCHEMBL24709786 | 0.64 | CSNK1D (0.34) | ADORA3CYP11B1CYP11B2 | |
| SCHEMBL21400917 | 0.64 | KDM4E (0.40) | KDM5AGAA |
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-2013092940-A1 | 2, 4-DIAMINE-PYRIMIDINE DERIVATIVE AS SERINE/THREONINE KINASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2013-06-27 | — | — | WO | disclosed |