Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 18/20 | 0.47 |
| ▸ | PDE4A | P27815 | 10/20 | 0.47 |
| ▸ | PDE4C | Q08493 | 10/20 | 0.47 |
| ▸ | PDE4D | Q08499 | 10/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | ABCB11 | O95342 | 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 | |
|---|---|---|---|---|
| SCHEMBL8169435 | 0.97 | PDE4B (0.43) | PDE4BPDE4APDE4CPDE4DALDH1A1 | |
| SCHEMBL7544021 | 0.87 | PDE4B (0.44) | PDE4BPDE4APDE4CPDE4DABCB11 | |
| SCHEMBL7549058 | 0.83 | MAP4K4 (0.48) | PDE4BPDE4APDE4CPDE4D | |
| SCHEMBL8164103 | 0.83 | PDE4A (0.43) | PDE4BPDE4APDE4CPDE4DALDH1A1 | |
| SCHEMBL7470900 | 0.82 | ALDH1A1 (0.51) | ALDH1A1 | |
| SCHEMBL28033753 | 0.80 | PDE4B (0.59) | PDE4BPDE4APDE4CPDE4D | |
| SCHEMBL8170486 | 0.79 | HPGD (0.50) | ALDH1A1 | |
| SCHEMBL7612296 | 0.79 | ALDH1A1 (0.43) | ALDH1A1ABCB11 | |
| SCHEMBL7612421 | 0.79 | SMPD1 (0.48) | ALDH1A1 | |
| SCHEMBL20189249 | 0.79 | PDE4B (0.50) | PDE4BPDE4APDE4CPDE4D |
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-6137003-A | Bis (haloethyl) aminobenzene derivatives | SHIONOGI BIORESEARCH (US) | 2000-10-24 | — | — | US | disclosed |