Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.34 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.34 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.33 |
| ▸ | DHFR | P00374 | 1/20 | 0.33 |
| ▸ | TYMS | P04818 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2093803 | 0.81 | CYP1A2 (0.33) | ALDH1A1KDM4EL3MBTL1CYP1A2CYP2A6 | |
| SCHEMBL6002696 | 0.78 | KDM4E (0.36) | ALDH1A1KDM4EL3MBTL1CYP1A2CYP2A6 | |
| SCHEMBL2094483 | 0.75 | CYP2A6 (0.37) | ALDH1A1KDM4EL3MBTL1MAPK1CYP1A2 | |
| SCHEMBL2095389 | 0.74 | — | — | |
| SCHEMBL6002428 | 0.72 | CYP1A2 (0.44) | ALDH1A1KDM4EL3MBTL1CYP1A2CYP2A6 | |
| SCHEMBL2094479 | 0.71 | CYP2A6 (0.41) | ALDH1A1KDM4EL3MBTL1MAPK1CYP1A2 | |
| SCHEMBL24970521 | 0.68 | GABRA1 (0.45) | ALDH1A1KDM4EMAPK1CYP1A2CYP2A6 | |
| SCHEMBL2090417 | 0.68 | CYP2A6 (0.38) | ALDH1A1KDM4ECYP1A2CYP2A6MAPT | |
| SCHEMBL6002815 | 0.67 | ALDH1A1 (0.39) | ALDH1A1KDM4EL3MBTL1MAPK1CYP1A2 | |
| SCHEMBL29620231 | 0.65 | TSHR (0.53) | ALDH1A1KDM4EL3MBTL1MAPK1CYP1A2 |
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 |