Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 1/20 | 0.46 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.46 |
| ▸ | LCK | P06239 | 5/20 | 0.42 |
| ▸ | AAK1 | Q2M2I8 | 4/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | BCL2 | P10415 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | MTOR | P42345 | 1/20 | 0.38 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | ATR | Q13535 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL16905389 | 1.00 | GSK3B (0.46) | GSK3BDYRK1ALCKAAK1ABL1 | |
| SCHEMBL31511994 | 0.88 | GSK3B (0.46) | GSK3BDYRK1ALCKAAK1BCL2 | |
| SCHEMBL12225872 | 0.86 | GSK3B (0.48) | GSK3BDYRK1ALCKAAK1CA12 | |
| SCHEMBL30298062 | 0.85 | GSK3B (0.46) | GSK3BDYRK1ALCKAAK1CA12 | |
| SCHEMBL26125387 | 0.85 | GSK3B (0.46) | GSK3BDYRK1ALCKAAK1CA12 | |
| SCHEMBL25347433 | 0.83 | GSK3B (0.44) | GSK3BDYRK1AAAK1BCL2MAPK1 | |
| SCHEMBL27067137 | 0.83 | GSK3B (0.44) | GSK3BDYRK1AAAK1BCL2MAPK1 | |
| SCHEMBL5908666 | 0.82 | GSK3B (0.46) | GSK3BDYRK1ALCKAAK1ABL1 | |
| SCHEMBL16908092 | 0.82 | GSK3B (0.43) | GSK3BDYRK1ABCL2MAPK1 | |
| SCHEMBL1430685 | 0.82 | GSK3B (0.43) | GSK3BDYRK1ALCKBCL2CA1 |
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-110678466-B | Diazanaphthalenes as HPK1 inhibitors | 豪夫迈·罗氏有限公司 | 2023-01-31 | — | — | CN | disclosed |