Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | CCR4 | P51679 | 2/20 | 0.32 |
| ▸ | LRRK2 | Q5S007 | 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 | |
|---|---|---|---|---|
| SCHEMBL29099699 | 0.83 | GRM5 (0.34) | GRM5 | |
| SCHEMBL20517233 | 0.83 | PDE4A (0.40) | — | |
| SCHEMBL30600994 | 0.83 | PDE4A (0.40) | — | |
| SCHEMBL15774252 | 0.74 | GRM5 (0.36) | GRM5CCR4 | |
| SCHEMBL20516589 | 0.69 | MAP4K1 (0.34) | — | |
| SCHEMBL20517546 | 0.68 | PDE4A (0.38) | — | |
| SCHEMBL30600901 | 0.68 | PDE4A (0.38) | — | |
| SCHEMBL29069627 | 0.67 | PDE4A (0.40) | — | |
| SCHEMBL30320884 | 0.67 | PDE4A (0.40) | — | |
| SCHEMBL6615369 | 0.65 | GRM5 (0.44) | GRM5 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117024411-A | Isoquinoline as HPK1 inhibitor | 豪夫迈·罗氏有限公司 | 2023-11-10 | — | — | CN | disclosed |
| CN-110709392-B | Isoquinoline as HPK1 inhibitor | 豪夫迈·罗氏有限公司 | 2023-09-29 | — | — | CN | disclosed |