Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | POLB | P06746 | 4/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 4/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | NSD2 | O96028 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.46 |
| ▸ | TNNI3 | P19429 | 1/20 | 0.46 |
| ▸ | TNNT2 | P45379 | 1/20 | 0.46 |
| ▸ | TNNC1 | P63316 | 1/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.42 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.42 |
| ▸ | HCAR3 | P49019 | 6/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30107994 | 0.88 | PTGS1 (0.50) | PTGS1ALDH1A1POLBMEN1KMT2A | |
| SCHEMBL30107959 | 0.85 | KDM4E (0.44) | ALDH1A1GAAADORA2AADORA1ADORA3 | |
| SCHEMBL30108019 | 0.83 | KEAP1 (0.39) | PTGS1ALDH1A1POLBL3MBTL1MEN1 | |
| SCHEMBL30108012 | 0.82 | TSHR (0.58) | PTGS1ALDH1A1POLBL3MBTL1GAA | |
| SCHEMBL30108014 | 0.82 | KDM4E (0.42) | ALDH1A1GAAADORA2AADORA1ADORA3 | |
| SCHEMBL30108051 | 0.82 | ALDH1A1 (0.47) | ALDH1A1POLBL3MBTL1MEN1KMT2A | |
| SCHEMBL30108028 | 0.81 | KDM4E (0.43) | PTGS1ALDH1A1L3MBTL1GAAADORA2A | |
| SCHEMBL30107951 | 0.80 | PTGS1 (0.46) | PTGS1ALDH1A1POLBMEN1KMT2A | |
| SCHEMBL30107978 | 0.79 | KDM4E (0.44) | ALDH1A1GAAADORA2AADORA1ADORA3 | |
| SCHEMBL30107980 | 0.78 | ROCK1 (0.45) | PTGS1ALDH1A1GAAADORA2AADORA1 |
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-2022203399-A1 | ADENOSINE A2A RECEPTOR ANTAGONIST AND USE THEREOF | 주식회사 스탠다임 | 2022-09-29 | — | — | WO | disclosed |