Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 4/20 | 0.58 |
| ▸ | CDK7 | P50613 | 1/20 | 0.55 |
| ▸ | JAK2 | O60674 | 1/20 | 0.55 |
| ▸ | JAK1 | P23458 | 1/20 | 0.55 |
| ▸ | CLK2 | P49760 | 4/20 | 0.54 |
| ▸ | CLK3 | P49761 | 4/20 | 0.54 |
| ▸ | DYRK1A | Q13627 | 4/20 | 0.54 |
| ▸ | PIM1 | P11309 | 2/20 | 0.53 |
| ▸ | AURKA | O14965 | 1/20 | 0.53 |
| ▸ | MAP2K4 | P45985 | 3/20 | 0.53 |
| ▸ | ITK | Q08881 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.50 |
| ▸ | MAPKAPK3 | Q16644 | 1/20 | 0.50 |
| ▸ | MAPK6 | Q16659 | 1/20 | 0.50 |
| ▸ | MAPKAPK5 | Q8IW41 | 1/20 | 0.50 |
| ▸ | ATR | Q13535 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL29172497 | 1.00 | LRRK2 (0.58) | LRRK2CDK7JAK2JAK1CLK2 | |
| SCHEMBL30725862 | 0.92 | PIM1 (0.60) | LRRK2CDK7JAK2JAK1CLK2 | |
| SCHEMBL29172527 | 0.92 | PIM1 (0.60) | LRRK2CDK7JAK2JAK1CLK2 | |
| SCHEMBL30725877 | 0.90 | CDK7 (0.67) | LRRK2CDK7JAK2JAK1CLK2 | |
| SCHEMBL29172495 | 0.90 | CDK7 (0.67) | LRRK2CDK7JAK2JAK1CLK2 | |
| SCHEMBL29172502 | 0.89 | DYRK1A (0.61) | LRRK2CDK7JAK2JAK1CLK2 | |
| SCHEMBL30725858 | 0.89 | DYRK1A (0.61) | LRRK2CDK7JAK2JAK1CLK2 | |
| SCHEMBL30725866 | 0.86 | LRRK2 (0.70) | LRRK2ITK | |
| SCHEMBL29172510 | 0.86 | LRRK2 (0.70) | LRRK2ITK | |
| SCHEMBL5373102 | 0.84 | PIM1 (0.59) | CDK7JAK2JAK1CLK2CLK3 |
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-117186066-A | Indazole ALK5 inhibitor and preparation method and application thereof | 中国药科大学 | 2023-12-08 | — | — | CN | disclosed |