Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | CFTR | P13569 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.32 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.32 |
| ▸ | RIPK1 | Q13546 | 3/20 | 0.32 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.31 |
| ▸ | SCN9A | Q15858 | 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 | |
|---|---|---|---|---|
| SCHEMBL25687220 | 1.00 | CNR1 (0.34) | CNR1CFTRKDM4EALDH1A1HTT | |
| SCHEMBL25279914 | 1.00 | CNR1 (0.34) | CNR1CFTRKDM4EALDH1A1HTT | |
| SCHEMBL25687225 | 0.94 | CFTR (0.35) | CNR1CFTRALDH1A1NPSR1RXFP1 | |
| SCHEMBL30006884 | 0.93 | CNR1 (0.34) | CNR1CFTRGABRA5MCHR1HTR2C | |
| SCHEMBL25687285 | 0.93 | CNR1 (0.34) | CNR1CFTRGABRA5MCHR1HTR2C | |
| SCHEMBL28909199 | 0.92 | CFTR (0.36) | CNR1CFTRROCK2ROCK1RIPK1 | |
| SCHEMBL25687507 | 0.92 | CFTR (0.36) | CNR1CFTRROCK2ROCK1RIPK1 | |
| SCHEMBL30007164 | 0.91 | P2RX7 (0.33) | CNR1CFTRALDH1A1ROCK2ROCK1 | |
| SCHEMBL25687297 | 0.91 | P2RX7 (0.33) | CNR1CFTRALDH1A1ROCK2ROCK1 | |
| SCHEMBL25233253 | 0.91 | CNR1 (0.39) | CNR1KDM4EALDH1A1HTTNPSR1 |
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 |