Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 13/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.36 |
| ▸ | DHODH | Q02127 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MITF | O75030 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | STAT3 | P40763 | 1/20 | 0.34 |
| ▸ | STAT1 | P42224 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.34 |
| ▸ | MAP2K4 | P45985 | 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 | |
|---|---|---|---|---|
| SCHEMBL25686642 | 0.89 | SCN9A (0.40) | ADORA2AADORA1ADORA3ADORA2BPTGS2 | |
| SCHEMBL30007267 | 0.89 | PTGS2 (0.38) | ADORA2AADORA1ADORA3ADORA2BPTGS2 | |
| SCHEMBL23958629 | 0.89 | PTGS2 (0.38) | ADORA2AADORA1ADORA3ADORA2BPTGS2 | |
| SCHEMBL23958817 | 0.78 | ADORA2A (0.42) | ADORA2AADORA1ADORA3ADORA2BDHODH | |
| SCHEMBL25686624 | 0.78 | ADORA2A (0.39) | ADORA2AADORA1ADORA3ADORA2BPTGS2 | |
| SCHEMBL23958624 | 0.75 | PTGS2 (0.36) | PTGS2SCN9AMAP2K4 | |
| SCHEMBL25686621 | 0.73 | PTGDR2 (0.38) | PTGS2LMNAMAP2K4 | |
| SCHEMBL23958600 | 0.72 | CFTR (0.36) | PTGS2SCN9APTGS1KDM4EMITF | |
| SCHEMBL28909129 | 0.70 | TRPV1 (0.34) | PTGS2SCN9APTGS1 | |
| SCHEMBL23958852 | 0.70 | CFTR (0.35) | ADORA2AADORA1PTGS2SCN9APTGS1 |
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 |