Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 14/20 | 0.65 |
| ▸ | PDE4A | P27815 | 14/20 | 0.60 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.48 |
| ▸ | PDE4D | Q08499 | 4/20 | 0.48 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7176953 | 0.90 | KCNH2 (0.54) | KCNH2PDE4ANPC1RAB9A | |
| SCHEMBL5339663 | 0.89 | PDE4A (0.76) | KCNH2PDE4APDE4BPDE4DPDE4C | |
| SCHEMBL8349787 | 0.86 | KCNH2 (0.66) | KCNH2PDE4APDE4BPDE4DPDE4C | |
| SCHEMBL5342005 | 0.86 | PDE4A (0.72) | KCNH2PDE4APDE4BPDE4DPDE4C | |
| SCHEMBL8247255 | 0.86 | ELANE (0.58) | KCNH2PDE4APDE4BPDE4DPDE4C | |
| SCHEMBL8437043 | 0.84 | PDE4A (0.54) | KCNH2PDE4APDE4BPDE4DPDE4C | |
| SCHEMBL1565419 | 0.84 | PDE4A (0.70) | KCNH2PDE4ANPC1RAB9A | |
| SCHEMBL6135868 | 0.84 | KCNH2 (0.71) | KCNH2PDE4APDE4BPDE4DPDE4C | |
| SCHEMBL7185413 | 0.84 | PDE4A (0.65) | KCNH2PDE4A | |
| SCHEMBL7185969 | 0.83 | PDE4A (0.62) | KCNH2PDE4A |
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 |
|---|---|---|---|---|---|---|---|
| US-7312334-B2 | Method of preparing inhibitors phosphodiesterase-4 | MERCK & CO. INC. (US) | 2007-12-25 | — | — | US | disclosed |