Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | AAK1 | Q2M2I8 | 7/20 | 0.38 |
| ▸ | CDC25B | P30305 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 8/20 | 0.35 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.34 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL31618253 | 0.85 | MAOA (0.38) | CYP1A2CYP11B1CYP11B2MAOAMAOB | |
| SCHEMBL4323285 | 0.78 | CYP1A2 (0.53) | CYP1A2CYP11B1CYP11B2MAOAMAOB | |
| SCHEMBL29792666 | 0.78 | CYP1A2 (0.53) | CYP1A2CYP11B1CYP11B2MAOAMAOB | |
| SCHEMBL147460 | 0.74 | — | — | |
| SCHEMBL6608536 | 0.74 | MAOA (0.55) | CYP1A2MAOAMAOBAAK1ROCK2 | |
| SCHEMBL2877256 | 0.74 | MAOA (0.53) | CYP1A2CYP11B1CYP11B2MAOAMAOB | |
| SCHEMBL31128508 | 0.74 | MAOA (0.53) | CYP1A2CYP11B1CYP11B2MAOAMAOB | |
| Hydrochloric Acid SCHEMBL2883050 | 0.73 | MAOA (0.52) | CYP1A2CYP11B1CYP11B2MAOAMAOB | |
| SCHEMBL135207 | 0.71 | MAOA (0.56) | CYP1A2MAOAMAOBCDC25B | |
| SCHEMBL29452852 | 0.71 | MAOA (0.56) | CYP1A2MAOAMAOBCDC25B |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008123756-A1 | A PHARMACEUTICAL COMPOSITIONS CONTAINING LACTON TYPE PYRIDINE DERIVATIVES AS AN EFFECTIVE INGREDIENT FOR THE PREVENTION AND TREATMENT OF ISCHEMIA | SK CHEMICALS CO., LTD. (KR) | 2008-10-16 | — | — | WO | claimed |