Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 10/20 | 0.39 |
| ▸ | MAPK13 | O15264 | 2/20 | 0.39 |
| ▸ | MAPK12 | P53778 | 2/20 | 0.39 |
| ▸ | MAPK11 | Q15759 | 2/20 | 0.39 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.37 |
| ▸ | BRAF | P15056 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.35 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.35 |
| ▸ | RAF1 | P04049 | 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 | |
|---|---|---|---|---|
| SCHEMBL25686895 | 1.00 | BCHE (0.40) | BCHEMAPK14MAPK13MAPK12MAPK11 | |
| SCHEMBL30211293 | 0.84 | MAPK14 (0.38) | BCHEMAPK14MAPK13MAPK12MAPK11 | |
| SCHEMBL30007243 | 0.83 | KMO (0.38) | MAPK14KDM4EALDH1A1RAB9ACSNK1E | |
| SCHEMBL26728885 | 0.80 | BCHE (0.40) | BCHEMAPK14MAPK13MAPK12MAPK11 | |
| SCHEMBL25686899 | 0.76 | BCHE (0.35) | BCHEMAPK14MAPK13MAPK12MAPK11 | |
| SCHEMBL25686621 | 0.76 | PTGDR2 (0.38) | BCHEMAPK14MAPK13MAPK12MAPK11 | |
| SCHEMBL28909214 | 0.75 | BCHE (0.35) | BCHEMAPK14MAPK13MAPK12MAPK11 | |
| SCHEMBL16198250 | 0.74 | MAP4K4 (0.34) | — | |
| SCHEMBL23930265 | 0.73 | ADORA2A (0.40) | MAPK14ALDH1A1BRAF | |
| SCHEMBL16132361 | 0.72 | KDM4E (0.46) | BCHEMAPK14MAPK13MAPK12MAPK11 |
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 |