Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK5 | Q00535 | 2/20 | 0.46 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.46 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.46 |
| ▸ | PIM1 | P11309 | 1/20 | 0.46 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.46 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.46 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.46 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.46 |
| ▸ | LTK | P29376 | 1/20 | 0.40 |
| ▸ | MST1R | Q04912 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | PARP10 | Q53GL7 | 7/20 | 0.36 |
| ▸ | PARP11 | Q9NR21 | 7/20 | 0.36 |
| ▸ | PRKCI | P41743 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 3/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL31264207 | 0.77 | CDK5 (0.46) | CDK5DYRK1ACLK4PIM1CSNK1A1 | |
| SCHEMBL30842095 | 0.77 | CDK5 (0.46) | CDK5DYRK1ACLK4PIM1CSNK1A1 | |
| SCHEMBL15566157 | 0.77 | CLK4 (0.46) | CDK5DYRK1ACLK4PIM1CSNK1A1 | |
| SCHEMBL16921409 | 0.77 | CDK5 (0.46) | CDK5DYRK1ACLK4PIM1CSNK1A1 | |
| SCHEMBL19984500 | 0.73 | CDK5 (0.42) | CDK5DYRK1ACLK4PIM1CSNK1A1 | |
| SCHEMBL30700995 | 0.72 | CDC7 (0.50) | CDK5DYRK1ACLK4PIM1CSNK1A1 | |
| SCHEMBL1335497 | 0.71 | DYRK1A (0.61) | CDK5DYRK1ACLK4PIM1CSNK1A1 | |
| SCHEMBL30233027 | 0.69 | DYRK1A (0.39) | CDK5DYRK1ACLK4PIM1CSNK1A1 | |
| SCHEMBL21990680 | 0.68 | L3MBTL1 (0.41) | CDK5DYRK1ACLK4PIM1CSNK1A1 | |
| SCHEMBL30913134 | 0.68 | PRKD1 (0.51) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-4005638-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2022-06-01 | — | — | EP | disclosed |