Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.41 |
| ▸ | CDC7 | O00311 | 1/20 | 0.41 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.41 |
| ▸ | MAPK9 | P45984 | 2/20 | 0.40 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.40 |
| ▸ | RAF1 | P04049 | 1/20 | 0.40 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.40 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 3/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.40 |
| ▸ | CLK1 | P49759 | 2/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.40 |
| ▸ | CLK2 | P49760 | 1/20 | 0.40 |
| ▸ | CLK3 | P49761 | 1/20 | 0.40 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11892623 | 0.89 | DYRK1A (0.47) | EIF2AK2CDK2HDAC1CLK1DYRK1A | |
| SCHEMBL11892639 | 0.87 | RPS6KB1 (0.46) | EIF2AK2RPS6KB1CLK1DYRK1ACLK4 | |
| SCHEMBL11892622 | 0.84 | FLT3 (0.42) | EIF2AK2CDK2HDAC1CLK1DYRK1A | |
| SCHEMBL11892641 | 0.84 | FYN (0.42) | CLK4CCNT1CDK9CYP3A4LMNA | |
| SCHEMBL11892635 | 0.81 | DYRK1A (0.47) | RPS6KB1MAPK9MAPK13MAPK12MAPK11 | |
| SCHEMBL11892624 | 0.80 | FLT3 (0.43) | RPS6KB1MAPK9MAPK13MAPK12MAPK11 | |
| SCHEMBL10353744 | 0.80 | MAPK8 (0.52) | CDC7RPS6KB1MAPK9MAPK13MAPK12 | |
| SCHEMBL10323153 | 0.80 | MAPK8 (0.52) | CDC7RPS6KB1MAPK9MAPK13MAPK12 | |
| SCHEMBL11892630 | 0.77 | METAP2 (0.50) | RPS6KB1CYP3A4DHFRNPSR1 | |
| SCHEMBL10323641 | 0.76 | FLT3 (0.58) | EIF2AK2DYRK1ADYRK1BMKNK1LMNA |
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-2012098068-A1 | PYRAZOLO PYRIMIDINES AS DYRK1A AND DYRK1B INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2012-07-26 | — | — | WO | disclosed |