Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | CTSA | P10619 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.32 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | RHOC | P08134 | 1/20 | 0.32 |
| ▸ | RHOA | P61586 | 1/20 | 0.32 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.32 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.32 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL25233253 | 1.00 | CNR1 (0.39) | CNR1MAPTTHRBGABRA5KDM4E | |
| SCHEMBL25687231 | 1.00 | CNR1 (0.39) | CNR1MAPTTHRBGABRA5KDM4E | |
| SCHEMBL25687225 | 0.94 | CFTR (0.35) | CNR1MAPTGABRA5ALDH1A1NPSR1 | |
| SCHEMBL25687233 | 0.93 | GABRA5 (0.37) | CNR1GABRA5CTSAROCK2ROCK1 | |
| SCHEMBL30007933 | 0.93 | GABRA5 (0.37) | CNR1GABRA5CTSAROCK2ROCK1 | |
| SCHEMBL25242930 | 0.93 | GABRA5 (0.37) | CNR1GABRA5CTSAROCK2ROCK1 | |
| SCHEMBL25687227 | 0.92 | POLB (0.35) | MAPTROCK2ROCK1 | |
| SCHEMBL23958737 | 0.92 | POLB (0.35) | MAPTROCK2ROCK1 | |
| SCHEMBL25279914 | 0.91 | CNR1 (0.34) | CNR1MAPTGABRA5KDM4EALDH1A1 | |
| SCHEMBL30007416 | 0.91 | CNR1 (0.34) | CNR1MAPTGABRA5KDM4EALDH1A1 |
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-115461336-A | RSV inhibiting 3-substituted quinoline and cinnoline derivatives | 爱尔兰詹森科学公司 | 2022-12-09 | — | — | CN | disclosed |