Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | OGG1 | O15527 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.33 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.33 |
| ▸ | CTSG | P08311 | 1/20 | 0.33 |
| ▸ | CMA1 | P23946 | 1/20 | 0.33 |
| ▸ | SYK | P43405 | 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 | |
|---|---|---|---|---|
| SCHEMBL15729955 | 0.81 | CYP2A6 (0.53) | ALDH1A1MAPK1KDM4EL3MBTL1CA2 | |
| SCHEMBL3276608 | 0.81 | CA2 (0.41) | ALDH1A1MAPK1KDM4EL3MBTL1CA2 | |
| SCHEMBL2090743 | 0.81 | CYP2A6 (0.36) | ALDH1A1MAPK1KDM4EL3MBTL1CA2 | |
| SCHEMBL13888151 | 0.79 | CTSG (0.47) | ALDH1A1CA2CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL8584219 | 0.79 | TAAR1 (0.50) | CA2OGG1CYP2A6DRD2DRD4 | |
| SCHEMBL6003593 | 0.78 | ALDH1A1 (0.39) | ALDH1A1KDM4ECA2CYP1A2CYP2D6 | |
| SCHEMBL3150930 | 0.76 | LMNA (0.41) | ALDH1A1MAPK1MCL1CYP1A2OGG1 | |
| SCHEMBL2092548 | 0.75 | CYP2A6 (0.41) | ALDH1A1MAPK1KDM4EL3MBTL1MCL1 | |
| SCHEMBL2091809 | 0.74 | DRD2 (0.32) | CA2OGG1CYP2A6DRD2DRD4 | |
| SCHEMBL4644784 | 0.73 | CYP2A6 (0.52) | ALDH1A1CA2CYP1A2CYP2D6CYP2C19 |
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 |