Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 2/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 6/20 | 0.36 |
| ▸ | DRD3 | P35462 | 4/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | HTR1D | P28221 | 1/20 | 0.35 |
| ▸ | HTR1B | P28222 | 1/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8745626 | 0.96 | TRPA1 (0.35) | NFE2L2TRPA1SLC6A4SLC6A3MAOB | |
| SCHEMBL8745185 | 0.91 | NFE2L2 (0.38) | NFE2L2TRPA1SLC6A4SLC6A3MAOB | |
| SCHEMBL8745156 | 0.90 | TNNC1 (0.38) | NFE2L2TRPA1SLC6A4SLC6A3MAOB | |
| SCHEMBL8745245 | 0.87 | SLC6A4 (0.35) | NFE2L2TRPA1SLC6A4SLC6A3MAOB | |
| SCHEMBL8745261 | 0.86 | TNNC1 (0.36) | NFE2L2TRPA1SLC6A4SLC6A3MAOB | |
| SCHEMBL8745212 | 0.85 | MAOB (0.41) | MAOBDRD2HTR2AHTR2CHTR2B | |
| SCHEMBL8745194 | 0.84 | TNNC1 (0.37) | MAOBMAOA | |
| SCHEMBL8745628 | 0.84 | NFE2L2 (0.41) | NFE2L2TRPA1 | |
| SCHEMBL8745290 | 0.83 | MAOB (0.43) | MAOBMAOAHTR2AHTR2C | |
| SCHEMBL8745218 | 0.82 | MAOB (0.35) | MAOB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0563981-B1 | Cis-1,4-substituted 2-butene derivative | CHISSO CORP (JP) | 1997-01-22 | — | — | EP | disclosed |
| US-5401434-A | Cis-1,4-substituted 2-butene derivative | CHISSO CORPORATION (JP) | 1995-03-28 | — | — | US | disclosed |
| EP-0563981-A2 | Cis-1,4-substituted 2-butene derivative | Chisso Corporation (JP) | 1993-10-06 | — | — | EP | disclosed |