Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHAT | P28329 | 4/20 | 0.40 |
| ▸ | SMPD2 | O60906 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.39 |
| ▸ | RXRA | P19793 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 2/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.38 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.38 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.38 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL615456 | 0.81 | SMPD2 (0.51) | CHATSMPD2MTNR1AMTNR1BRXRA | |
| SCHEMBL615455 | 0.81 | SMPD2 (0.51) | CHATSMPD2MTNR1AMTNR1BRXRA | |
| SCHEMBL28642226 | 0.80 | RXRA (0.52) | CHATMTNR1AMTNR1BRXRAPTGS1 | |
| SCHEMBL6003606 | 0.79 | CHAT (0.43) | CHATMTNR1AMTNR1BRXRAPTGS1 | |
| SCHEMBL133603 | 0.78 | CHAT (0.46) | CHATMTNR1AMTNR1BRXRACNR1 | |
| SCHEMBL816177 | 0.77 | TSHR (0.50) | CHATMTNR1AMTNR1BRXRAGRIN2D | |
| Methylamine SCHEMBL27560497 | 0.75 | GRIN2D (0.44) | CHATMTNR1AMTNR1BRXRAPTGS1 | |
| SCHEMBL4626594 | 0.73 | RXRA (0.57) | CHATMTNR1AMTNR1BRXRAPTGS1 | |
| SCHEMBL4626591 | 0.73 | RXRA (0.57) | CHATMTNR1AMTNR1BRXRAPTGS1 | |
| SCHEMBL29399914 | 0.73 | RXRA (0.57) | CHATMTNR1AMTNR1BRXRAPTGS1 |
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 |