Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.42 |
| ▸ | MAP3K5 | Q99683 | 2/20 | 0.41 |
| ▸ | JUN | P05412 | 2/20 | 0.39 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 13/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 10/20 | 0.37 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.37 |
| ▸ | PRKACA | P17612 | 1/20 | 0.36 |
| ▸ | PRKACG | P22612 | 1/20 | 0.36 |
| ▸ | PRKACB | P22694 | 1/20 | 0.36 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.34 |
| ▸ | BRAF | P15056 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30512127 | 0.85 | MAP3K5 (0.53) | MAP4K1MAP3K5JUNMAPK10ROCK2 | |
| SCHEMBL25881300 | 0.85 | MAP3K5 (0.53) | MAP4K1MAP3K5JUNMAPK10ROCK2 | |
| SCHEMBL25882124 | 0.79 | MAP3K5 (0.63) | MAP4K1MAP3K5ROCK2ROCK1BRAF | |
| SCHEMBL25881895 | 0.78 | CREBBP (0.46) | MAP3K5BRAF | |
| SCHEMBL25879716 | 0.77 | PTK2 (0.39) | — | |
| SCHEMBL25881914 | 0.75 | MAP3K5 (0.52) | MAP4K1MAP3K5JUNMAPK10ROCK2 | |
| SCHEMBL30512125 | 0.74 | MAP4K1 (0.59) | MAP4K1MAP3K5JUNMAPK10ROCK2 | |
| SCHEMBL30512117 | 0.72 | MAP4K1 (0.41) | MAP4K1MAP3K5JUNMAPK10BRAF | |
| SCHEMBL25882103 | 0.72 | MAP4K1 (0.41) | MAP4K1MAP3K5JUNMAPK10BRAF | |
| SCHEMBL30512131 | 0.72 | MAP3K5 (0.61) | MAP4K1MAP3K5JUNMAPK10ROCK2 |
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-2023138412-A1 | FUSED PYRIMIDIN-2-AMINE COMPOUNDS AS CDK20 INHIBITORS | INSILICO MEDICINE IP LIMITED (CN) | 2023-07-27 | — | — | WO | disclosed |