Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP1 | P03956 | 3/20 | 0.35 |
| ▸ | MMP9 | P14780 | 3/20 | 0.35 |
| ▸ | MMP13 | P45452 | 3/20 | 0.35 |
| ▸ | HTR7 | P34969 | 5/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.35 |
| ▸ | PRKACA | P17612 | 4/20 | 0.35 |
| ▸ | PRKCD | Q05655 | 4/20 | 0.35 |
| ▸ | HTR1D | P28221 | 3/20 | 0.35 |
| ▸ | HTR2B | P41595 | 3/20 | 0.35 |
| ▸ | PRKD3 | O94806 | 3/20 | 0.35 |
| ▸ | PRKCZ | Q05513 | 3/20 | 0.35 |
| ▸ | PRKACG | P22612 | 3/20 | 0.35 |
| ▸ | PRKACB | P22694 | 3/20 | 0.35 |
| ▸ | HTR1A | P08908 | 2/20 | 0.35 |
| ▸ | DRD2 | P14416 | 2/20 | 0.35 |
| ▸ | DRD3 | P35462 | 2/20 | 0.35 |
| ▸ | PLK4 | O00444 | 2/20 | 0.35 |
| ▸ | MARK3 | P27448 | 2/20 | 0.35 |
| ▸ | PRKAA1 | Q13131 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30438744 | 0.88 | MMP1 (0.38) | MMP1MMP9MMP13HTR7ROCK2 | |
| SCHEMBL30438695 | 0.80 | ROCK1 (0.41) | HTR7ROCK2ROCK1PRKACAPRKCD | |
| SCHEMBL23795358 | 0.80 | ROCK1 (0.41) | HTR7ROCK2ROCK1PRKACAPRKCD | |
| SCHEMBL23795329 | 0.80 | ROCK1 (0.41) | HTR7ROCK2ROCK1PRKACAPRKCD | |
| SCHEMBL30439149 | 0.80 | MMP1 (0.45) | MMP1MMP9MMP13HTR7HTR1D | |
| SCHEMBL30439065 | 0.76 | TAAR1 (0.43) | MMP1MMP9MMP13HTR7ROCK2 | |
| SCHEMBL30438733 | 0.73 | ROCK2 (0.38) | MMP1MMP9MMP13HTR7ROCK2 | |
| SCHEMBL30439166 | 0.70 | MMP1 (0.47) | MMP1MMP9MMP13HTR6 | |
| SCHEMBL30439345 | 0.70 | ROCK2 (0.51) | MMP1MMP9MMP13HTR7ROCK2 | |
| SCHEMBL23795312 | 0.69 | ROCK1 (0.42) | HTR7ROCK2ROCK1PRKACAPRKCD |
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-111116555-B | Rho kinase inhibitor and preparation method and application thereof | 北京盈科瑞创新药物研究有限公司 | 2023-06-02 | — | — | CN | disclosed |