Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | TNNC1 | P63316 | 1/20 | 0.40 |
| ▸ | TLR4 | O00206 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.32 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.32 |
| ▸ | GPR183 | P32249 | 1/20 | 0.32 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.31 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 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 | |
|---|---|---|---|---|
| SCHEMBL8745290 | 0.96 | MAOB (0.43) | MAOAMAOBTNNC1HRH3ITGB3 | |
| SCHEMBL8747230 | 0.93 | MAOA (0.39) | MAOAMAOBTNNC1ITGB3ITGA2B | |
| SCHEMBL8745203 | 0.91 | TNNC1 (0.45) | MAOAMAOBTNNC1HRH3ITGB3 | |
| SCHEMBL8745280 | 0.91 | TNNC1 (0.45) | TNNC1HRH3CYP2C9HTR2AHTR2C | |
| SCHEMBL8745257 | 0.90 | TNNC1 (0.35) | MAOAMAOBTNNC1TLR4CYP2C9 | |
| SCHEMBL8745231 | 0.89 | MAOB (0.42) | MAOAMAOBTNNC1ITGB3ITGA2B | |
| SCHEMBL8747219 | 0.86 | TNNC1 (0.48) | TNNC1HRH3CYP2C9HTR2AHTR2C | |
| SCHEMBL8745255 | 0.86 | TNNC1 (0.48) | MAOAMAOBTNNC1HRH3ITGB3 | |
| SCHEMBL8745218 | 0.86 | MAOB (0.35) | MAOBTLR4GPR183CYP2C9 | |
| SCHEMBL8745194 | 0.85 | TNNC1 (0.37) | MAOAMAOBTNNC1CYP2C9 |
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 |