Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP1 | P03956 | 4/20 | 0.45 |
| ▸ | MMP9 | P14780 | 4/20 | 0.45 |
| ▸ | MMP13 | P45452 | 4/20 | 0.45 |
| ▸ | HTR6 | P50406 | 3/20 | 0.41 |
| ▸ | MMP3 | P08254 | 1/20 | 0.39 |
| ▸ | MMP7 | P09237 | 1/20 | 0.39 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 2/20 | 0.37 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.36 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.36 |
| ▸ | APLNR | P35414 | 1/20 | 0.35 |
| ▸ | USP30 | Q70CQ3 | 2/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 2/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | HTR1D | P28221 | 1/20 | 0.34 |
| ▸ | HTR1B | P28222 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 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 | |
|---|---|---|---|---|
| SCHEMBL30439166 | 0.90 | MMP1 (0.47) | MMP1MMP9MMP13HTR6MMP3 | |
| SCHEMBL23795385 | 0.85 | MMP13 (0.41) | MMP1MMP9MMP13HTR6MMP3 | |
| SCHEMBL24177988 | 0.85 | MMP13 (0.41) | MMP1MMP9MMP13HTR6MMP3 | |
| SCHEMBL30439034 | 0.80 | MMP1 (0.35) | MMP1MMP9MMP13HTR6HTR7 | |
| SCHEMBL30439444 | 0.79 | MMP13 (0.43) | MMP1MMP9MMP13HTR6MMP3 | |
| SCHEMBL30439332 | 0.76 | MMP13 (0.45) | MMP1MMP9MMP13HTR6MMP3 | |
| SCHEMBL23795403 | 0.74 | MMP13 (0.43) | MMP1MMP9MMP13HTR6MMP3 | |
| SCHEMBL24178165 | 0.74 | MMP13 (0.43) | MMP1MMP9MMP13HTR6MMP3 | |
| SCHEMBL30439175 | 0.74 | MMP13 (0.43) | MMP1MMP9MMP13HTR6MMP3 | |
| SCHEMBL30439085 | 0.70 | CNR1 (0.45) | MMP1MMP9MMP13HTR6MMP3 |
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 |