Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | PTGFR | P43088 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | ACSS2 | Q9NR19 | 1/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.32 |
| ▸ | CTSA | P10619 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 2/20 | 0.31 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.31 |
| ▸ | ROCK1 | Q13464 | 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 | |
|---|---|---|---|---|
| SCHEMBL25280846 | 0.83 | CFTR (0.38) | CFTRALDH1A1KDM4EHTTNPSR1 | |
| SCHEMBL30007790 | 0.83 | CFTR (0.38) | CFTRALDH1A1KDM4EHTTNPSR1 | |
| SCHEMBL25687207 | 0.83 | CFTR (0.38) | CFTRALDH1A1KDM4EHTTNPSR1 | |
| SCHEMBL25687220 | 0.82 | CNR1 (0.34) | CFTRALDH1A1KDM4EHTTNPSR1 | |
| SCHEMBL30007416 | 0.82 | CNR1 (0.34) | CFTRALDH1A1KDM4EHTTNPSR1 | |
| SCHEMBL25279914 | 0.82 | CNR1 (0.34) | CFTRALDH1A1KDM4EHTTNPSR1 | |
| SCHEMBL23958786 | 0.81 | IRAK4 (0.32) | CFTRLMNANR1I2MAPT | |
| SCHEMBL23958810 | 0.81 | CFTR (0.34) | CFTRLMNATP53MAPTSMN1; SMN2 | |
| SCHEMBL23905869 | 0.80 | GABRA5 (0.32) | ALDH1A1PTGFRLMNATP53GABRA5 | |
| SCHEMBL23958806 | 0.79 | CFTR (0.34) | CFTRALDH1A1KDM4EPTGFRLMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021214136-A1 | RSV INHIBITING 3-SUBSTITUTED QUINOLINE AND CINNOLINE DERIVATIVES | Janssen Sciences Ireland Unlimited Company (IE) | 2021-10-28 | — | — | WO | disclosed |