Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNNC1 | P63316 | 1/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.35 |
| ▸ | SPHK1 | Q9NYA1 | 6/20 | 0.33 |
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.33 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.32 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | NMT1 | P30419 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8745255 | 0.96 | TNNC1 (0.48) | TNNC1MAOAMAOBCYP2D6CYP2C9 | |
| SCHEMBL8745150 | 0.95 | TNNC1 (0.45) | TNNC1CYP2D6CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL8745282 | 0.91 | TNNC1 (0.41) | TNNC1CYP2D6CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL8745162 | 0.91 | TNNC1 (0.48) | TNNC1CYP2D6CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL8745253 | 0.91 | MAOA (0.40) | TNNC1MAOAMAOBCYP2C9ITGB3 | |
| SCHEMBL8745280 | 0.90 | TNNC1 (0.45) | TNNC1CYP2D6CYP2C9CYP3A4S1PR3 | |
| SCHEMBL8747230 | 0.90 | MAOA (0.39) | TNNC1MAOAMAOBITGB3ITGA2B | |
| SCHEMBL8745277 | 0.89 | TNNC1 (0.44) | TNNC1CYP2D6CYP2C9CYP3A4S1PR3 | |
| SCHEMBL8745311 | 0.87 | TNNC1 (0.43) | TNNC1CYP2D6CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL8745290 | 0.86 | MAOB (0.43) | TNNC1MAOAMAOBCYP2C9ITGB3 |
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 |