Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 2/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.30 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.30 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3694128 | 0.88 | HTR1A (0.32) | HTR1AADRA1DADRA1AADRA1B | |
| SCHEMBL5262026 | 0.86 | KCNH2 (0.32) | HTR1AADRA1DADRA1AADRA1B | |
| SCHEMBL5263325 | 0.85 | LMNA (0.37) | — | |
| SCHEMBL5254100 | 0.81 | KCNH2 (0.36) | — | |
| SCHEMBL3686883 | 0.78 | KCNH2 (0.34) | — | |
| SCHEMBL3694994 | 0.78 | — | — | |
| SCHEMBL2208293 | 0.74 | ALDH1A1 (0.33) | — | |
| SCHEMBL5653235 | 0.74 | KCNH2 (0.35) | HTR1AADRA1DADRA1AADRA1B | |
| SCHEMBL622307 | 0.74 | — | — | |
| SCHEMBL622081 | 0.73 | — | — |
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-1399443-B1 | NITROGEN-CONTAINING BICYCLIC HETEROCYCLES FOR USE AS ANTIBACTERIALS | SMITHKLINE BEECHAM PLC (GB) | 2007-12-12 | — | — | EP | claimed |