Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | CFTR | P13569 | 3/20 | 0.33 |
| ▸ | NR3C1 | P04150 | 6/20 | 0.31 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.31 |
| ▸ | SLC34A1 | Q06495 | 1/20 | 0.31 |
| ▸ | PGR | P06401 | 1/20 | 0.31 |
| ▸ | HRH2 | P25021 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | HTR2B | P41595 | 1/20 | 0.30 |
| ▸ | BRAF | P15056 | 1/20 | 0.30 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.30 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.30 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23958662 | 1.00 | ADORA2A (0.33) | ADORA2AADORA2BADORA1CFTRNR3C1 | |
| SCHEMBL30007397 | 0.90 | SLC34A1 (0.34) | ADORA2AADORA2BADORA1CFTRNR3C1 | |
| SCHEMBL25686856 | 0.90 | SLC34A1 (0.34) | ADORA2AADORA2BADORA1CFTRNR3C1 | |
| SCHEMBL25423458 | 0.83 | CFTR (0.37) | CFTRBRAFMEN1KMT2A | |
| SCHEMBL26727261 | 0.76 | CFTR (0.34) | ADORA2AADORA2BADORA1CFTRTNIK | |
| SCHEMBL30007279 | 0.74 | SLC34A1 (0.35) | ADORA2AADORA2BADORA1SLC34A1BRAF | |
| SCHEMBL23958637 | 0.74 | SLC34A1 (0.35) | ADORA2AADORA2BADORA1SLC34A1BRAF | |
| SCHEMBL28960596 | 0.73 | CFTR (0.32) | CFTRTNIKTGFBR1MEN1KMT2A | |
| SCHEMBL23958949 | 0.72 | CFTR (0.35) | ADORA2AADORA1CFTRSLC34A1BRAF | |
| SCHEMBL23958787 | 0.71 | SLC34A1 (0.33) | CFTRNR3C1SLC34A1HRH2HRH3 |
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 |