Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 10/20 | 0.38 |
| ▸ | MAPK11 | Q15759 | 6/20 | 0.38 |
| ▸ | MAPK13 | O15264 | 4/20 | 0.38 |
| ▸ | MAPK12 | P53778 | 4/20 | 0.38 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.36 |
| ▸ | RAF1 | P04049 | 1/20 | 0.36 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CSNK1D | P48730 | 4/20 | 0.35 |
| ▸ | BRAF | P15056 | 1/20 | 0.35 |
| ▸ | CSNK1E | P49674 | 2/20 | 0.34 |
| ▸ | TDO2 | P48775 | 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 | |
|---|---|---|---|---|
| SCHEMBL23958623 | 1.00 | MAPK14 (0.38) | MAPK14MAPK11MAPK13MAPK12PDE3B | |
| SCHEMBL30211293 | 0.84 | MAPK14 (0.38) | MAPK14MAPK11MAPK13MAPK12PDE3B | |
| SCHEMBL23958624 | 0.76 | PTGS2 (0.36) | MAPK14PDE3BPDE3A | |
| SCHEMBL30007231 | 0.71 | BCHE (0.40) | MAPK14MAPK11MAPK13MAPK12PDE3B | |
| SCHEMBL25686895 | 0.71 | BCHE (0.40) | MAPK14MAPK11MAPK13MAPK12PDE3B | |
| SCHEMBL31309443 | 0.71 | ADORA2A (0.43) | MAPK14KDM4EALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL25686618 | 0.69 | AAK1 (0.38) | — | |
| SCHEMBL23930180 | 0.68 | ERBB2 (0.42) | PDE3BPDE3ABCHEKDM4EALDH1A1 | |
| SCHEMBL26728885 | 0.68 | BCHE (0.40) | MAPK14MAPK11MAPK13MAPK12PDE3B | |
| SCHEMBL16132361 | 0.67 | KDM4E (0.46) | MAPK14MAPK11MAPK13MAPK12BCHE |
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 |