Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.34 |
| ▸ | PDE5A | O76074 | 1/20 | 0.33 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.33 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.33 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.33 |
| ▸ | CDC7 | O00311 | 1/20 | 0.33 |
| ▸ | PLK4 | O00444 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
| ▸ | CHUK | O15111 | 1/20 | 0.33 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.33 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | PAK4 | O96013 | 1/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28560027 | 0.80 | DHFR (0.39) | ADORA3ADORA2AADORA1ADORA2BCDC7 | |
| SCHEMBL28566844 | 0.76 | DHFR (0.40) | ADORA3ADORA2AADORA1ADORA2BCDC7 | |
| SCHEMBL28913415 | 0.75 | DHFR (0.42) | ADORA3ADORA2AADORA1ADORA2BPDPK1 | |
| SCHEMBL25403426 | 0.74 | ALDH1A1 (0.38) | ADORA3ADORA2AADORA1ADORA2BMAPK1 | |
| SCHEMBL4119540 | 0.73 | KDM4E (0.40) | TSHRNR1H3 | |
| SCHEMBL10529535 | 0.73 | ADORA3 (0.37) | ADORA3ADORA2AADORA1PDE5APDE3B | |
| SCHEMBL28559979 | 0.72 | ADORA2A (0.37) | ADORA3ADORA2AADORA1ADORA2BPDE5A | |
| SCHEMBL25404388 | 0.71 | L3MBTL1 (0.40) | MAPK1TSHR | |
| SCHEMBL27843948 | 0.71 | KCNH2 (0.41) | ADORA3ADORA2AADORA1ADORA2BPDE5A | |
| Octane SCHEMBL28114785 | 0.71 | GAA (0.42) | ADORA2BPDE5APDE3BPDE3AGPR84 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1678185-A1 | 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2006-07-12 | — | — | EP | disclosed |
| WO-2005042542-A1 | 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2005-05-12 | — | — | WO | disclosed |