Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 3/20 | 0.34 |
| ▸ | CNR2 | P34972 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | CTSA | P10619 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | ACSS2 | Q9NR19 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | ABCB1 | P08183 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23958990 | 0.94 | CFTR (0.33) | CFTRCNR2LMNATP53KCNH2 | |
| SCHEMBL23958652 | 0.86 | LMNA (0.33) | CFTRCNR2LMNATP53KCNH2 | |
| SCHEMBL23958776 | 0.86 | LMNA (0.36) | CFTRLMNATP53KCNH2ALDH1A1 | |
| SCHEMBL23958797 | 0.86 | CFTR (0.36) | CFTRLMNATP53ALDH1A1SMN1; SMN2 | |
| SCHEMBL26766103 | 0.85 | IRAK4 (0.39) | CFTRLMNATP53KCNH2 | |
| SCHEMBL23958874 | 0.82 | CTSA (0.35) | CTSAACSS2ROCK2ROCK1 | |
| SCHEMBL25275834 | 0.82 | CFTR (0.36) | CFTRCNR2CTSAMAPTCNR1 | |
| SCHEMBL25687253 | 0.82 | CFTR (0.36) | CFTRCNR2CTSAMAPTCNR1 | |
| SCHEMBL25698171 | 0.81 | PDE4B (0.31) | ACSS2 | |
| SCHEMBL23958692 | 0.81 | CTSA (0.36) | CTSAALDH1A1POLBROCK2ROCK1 |
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 |