Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | PDE3B | Q13370 | 3/20 | 0.40 |
| ▸ | PDE3A | Q14432 | 3/20 | 0.40 |
| ▸ | P2RY12 | Q9H244 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.37 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.37 |
| ▸ | PRKAB2 | O43741 | 4/20 | 0.36 |
| ▸ | PRKAG1 | P54619 | 4/20 | 0.36 |
| ▸ | PRKAA2 | P54646 | 4/20 | 0.36 |
| ▸ | PRKAA1 | Q13131 | 4/20 | 0.36 |
| ▸ | PRKAG3 | Q9UGI9 | 4/20 | 0.36 |
| ▸ | PRKAG2 | Q9UGJ0 | 4/20 | 0.36 |
| ▸ | PRKAB1 | Q9Y478 | 4/20 | 0.36 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6016024 | 0.81 | MAOA (0.36) | MAOACYP3A4 | |
| SCHEMBL6015813 | 0.80 | KEAP1 (0.46) | MAOAALDH1A1PARP1 | |
| SCHEMBL6345184 | 0.80 | HPGD (0.47) | PDE3BPDE3AALDH1A1CYP3A4SMN1; SMN2 | |
| SCHEMBL6015768 | 0.79 | KDM4E (0.47) | MAOAALDH1A1PARP1SMN1; SMN2 | |
| SCHEMBL6015910 | 0.78 | PDE3B (0.49) | PDE3BPDE3AP2RY12ALDH1A1PDE2A | |
| SCHEMBL6015858 | 0.77 | TDP1 (0.33) | — | |
| SCHEMBL6016063 | 0.76 | LTA4H (0.55) | — | |
| SCHEMBL6015872 | 0.76 | LTA4H (0.55) | — | |
| SCHEMBL4602254 | 0.75 | ALOX5 (0.50) | MAOAALDH1A1GAASMN1; SMN2 | |
| SCHEMBL7620982 | 0.75 | HTR1A (0.42) | ALDH1A1GAA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7049312-B1 | Benzothiazinone and benzoxazinone compounds | ABBOTT GMBH & CO. KG (DE) | 2006-05-23 | — | — | US | claimed |
| EP-1181282-A2 | BENZOTHIAZINONE AND BENZOXAZINONE COMPOUNDS | BASF AKTIENGESELLSCHAFT (DE) | 2002-02-27 | — | — | EP | claimed |
| WO-2000075139-A2 | BENZOTHIAZINONE AND BENZOXAZINONE COMPOUNDS | BASF AKTIENGESELLSCHAFT (DE) | 2000-12-14 | — | — | WO | claimed |
| US-7049312-B1 | Benzothiazinone and benzoxazinone compounds | ABBOTT GMBH & CO. KG (DE) | 2006-05-23 | — | — | US | disclosed |