Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 3/20 | 0.37 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.34 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.33 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9865651 | 0.83 | HCAR1 (0.33) | NFE2L2 | |
| SCHEMBL9866930 | 0.81 | ALDH1A1 (0.34) | NFE2L2 | |
| SCHEMBL9866038 | 0.78 | PDE4A (0.37) | PDE4APDE4CPDE4DNFE2L2CXCR2 | |
| SCHEMBL9866594 | 0.76 | KEAP1 (0.42) | NFE2L2 | |
| SCHEMBL9867527 | 0.75 | TRPV3 (0.44) | — | |
| SCHEMBL6985382 | 0.73 | PDE4A (0.40) | PDE4APDE4CPDE4D | |
| SCHEMBL9865337 | 0.73 | HSP90AA1 (0.32) | — | |
| SCHEMBL10743042 | 0.70 | CNR2 (0.37) | PDE4APDE4CPDE4DCXCR2CXCR1 | |
| SCHEMBL25406591 | 0.70 | PDE4A (0.40) | PDE4APDE4CPDE4D | |
| SCHEMBL1018225 | 0.70 | PDE4A (0.45) | PDE4APDE4CPDE4DNFE2L2 |
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-4987141-A | DERIVATIVES OF BENZENE OR PYRIDINE HAVING SULFONATE AND SULFENYL, SULFONIMIDE OR SULFONAMIDE GROUPS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1991-01-22 | — | — | US | disclosed |