Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 8/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 8/20 | 0.41 |
| ▸ | RORC | P51449 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | PLK1 | P53350 | 1/20 | 0.39 |
| ▸ | HTR3A | P46098 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4067237 | 0.92 | PDE4A (0.44) | PDE4AKCNH2RORCHTR3AMEN1 | |
| SCHEMBL4070686 | 0.90 | PDE4A (0.41) | PDE4APDE4BKCNH2RORCHDAC1 | |
| SCHEMBL4236193 | 0.89 | KDR (0.39) | PDE4BHDAC1HDAC2PLK1HTR3A | |
| Hydrochloric Acid SCHEMBL4236283 | 0.88 | KDR (0.39) | PDE4BHDAC1HDAC2PLK1HTR3A | |
| SCHEMBL4063596 | 0.84 | PDE4A (0.42) | PDE4AKCNH2RORCHTR3AMAP3K14 | |
| SCHEMBL4061844 | 0.83 | PDE4A (0.41) | PDE4AKCNH2RORCHTR3AMAP3K14 | |
| SCHEMBL4058513 | 0.82 | KCNH2 (0.47) | PDE4AKCNH2RORCHTR3A | |
| SCHEMBL4063703 | 0.82 | PDE4A (0.48) | PDE4AKCNH2HTR3AMAP3K14 | |
| SCHEMBL4059266 | 0.81 | HTR3A (0.55) | PDE4AKCNH2RORCHTR3A | |
| SCHEMBL4061518 | 0.81 | PDE4A (0.41) | PDE4AKCNH2RORCHTR3A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1641791-B1 | 3-(GUANIDINOCARBONYL)HETEROCYCLE DERIVATIVES, PREPARATION PROCESS AND INTERMEDIATES OF THIS PROCESS, THEIR USE AS MEDICAMENTS, AND PHARMACEUTICAL COMPOSITIONS INCLUDING THEM | SANOFI AVENTIS DEUTSCHLAND (DE) | 2009-07-29 | — | — | EP | claimed |