Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 1/20 | 0.37 |
| ▸ | MTOR | P42345 | 1/20 | 0.37 |
| ▸ | CCNC | P24863 | 2/20 | 0.36 |
| ▸ | CDK8 | P49336 | 2/20 | 0.36 |
| ▸ | CMA1 | P23946 | 11/20 | 0.34 |
| ▸ | MMP12 | P39900 | 2/20 | 0.34 |
| ▸ | MMP13 | P45452 | 2/20 | 0.34 |
| ▸ | SLC9A3 | P48764 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
| ▸ | TNKS | O95271 | 1/20 | 0.33 |
| ▸ | IDH1 | O75874 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29130991 | 0.92 | CMA1 (0.35) | PIK3CAMTORCCNCCDK8CMA1 | |
| SCHEMBL30602385 | 0.80 | PIK3CA (0.46) | PIK3CAMTORCCNCCDK8PDE10A | |
| SCHEMBL9997046 | 0.80 | PIK3CA (0.46) | PIK3CAMTORCCNCCDK8PDE10A | |
| SCHEMBL792237 | 0.78 | CCNC (0.41) | PIK3CAMTORCCNCCDK8CMA1 | |
| SCHEMBL18048607 | 0.78 | ROCK2 (0.39) | — | |
| SCHEMBL850221 | 0.77 | TSHR (0.50) | PIK3CAMTORCCNCCDK8CMA1 | |
| SCHEMBL29130956 | 0.77 | ALDH1A1 (0.42) | — | |
| SCHEMBL29130939 | 0.77 | DRD2 (0.35) | — | |
| SCHEMBL12445267 | 0.77 | PIK3CA (0.46) | PIK3CAMTORPDE10A | |
| SCHEMBL15033664 | 0.76 | PIK3CA (0.39) | PIK3CAMTORCCNCCDK8IDH1 |
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-117069724-A | Fused ring compounds, pharmaceutical compositions and uses | 上海赛默罗德生物科技有限公司 | 2023-11-17 | — | — | CN | disclosed |