Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.44 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | DAO | P14920 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | AHR | P35869 | 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 | |
|---|---|---|---|---|
| SCHEMBL2094377 | 0.81 | CYP1A2 (0.44) | CYP1A2CYP2A6NR4A2DAOSMN1; SMN2 | |
| SCHEMBL2093780 | 0.74 | CYP1A2 (0.50) | CYP1A2CYP2A6NR4A2KDM4ELMNA | |
| SCHEMBL2090259 | 0.73 | CYP1A2 (0.36) | CYP1A2CYP2A6NR4A2KDM4EALDH1A1 | |
| SCHEMBL6003393 | 0.72 | ALDH1A1 (0.36) | CYP1A2CYP2A6KDM4EALDH1A1TSHR | |
| SCHEMBL2093776 | 0.71 | CYP1A2 (0.52) | CYP1A2CYP2A6NR4A2LMNAALDH1A1 | |
| SCHEMBL2090417 | 0.69 | CYP2A6 (0.38) | CYP1A2CYP2A6KDM4ELMNAALDH1A1 | |
| SCHEMBL6002962 | 0.68 | CYP1A2 (0.38) | CYP1A2CYP2A6KDM4ELMNAALDH1A1 | |
| SCHEMBL12770134 | 0.67 | CYP1A2 (0.59) | CYP1A2CYP2A6NR4A2KDM4ELMNA | |
| SCHEMBL28118419 | 0.66 | — | — | |
| SCHEMBL29629127 | 0.65 | CYP1A2 (1.00) | CYP1A2CYP2A6NR4A2KDM4ELMNA |
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 |