Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 16/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18059592 | 0.88 | MAOA (0.49) | MAOAKCNH2MAOB | |
| SCHEMBL2501174 | 0.88 | MAOA (0.49) | MAOAKCNH2MAOB | |
| SCHEMBL2478686 | 0.81 | MAOA (0.33) | MAOA | |
| SCHEMBL2509465 | 0.81 | MAOA (0.50) | MAOAKCNH2MAOB | |
| SCHEMBL18059602 | 0.81 | MAOA (0.50) | MAOAKCNH2MAOB | |
| SCHEMBL12197576 | 0.80 | MAOA (0.41) | MAOAKCNH2 | |
| SCHEMBL18059599 | 0.80 | CYP3A4 (0.42) | MAOAKCNH2CYP3A4CYP2D6 | |
| SCHEMBL12196635 | 0.80 | CYP3A4 (0.42) | MAOAKCNH2CYP3A4CYP2D6 | |
| SCHEMBL12197566 | 0.79 | MAOA (0.40) | MAOAKCNH2MAOBCYP3A4CYP2D6 | |
| SCHEMBL4488687 | 0.78 | MAOA (0.57) | MAOAKCNH2MAOBCYP3A4CYP2D6 |
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-2367820-A2 | Novel antimicrobials | Panacea Biotec Limited (IN) | 2011-09-28 | — | — | EP | disclosed |
| WO-2010058423-A2 | NOVEL ANTIMICROBIALS | PANACEA BIOTEC LTD. (IN) | 2010-05-27 | — | — | WO | disclosed |