Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | DGKA | P23743 | 1/20 | 0.32 |
| ▸ | MGLL | Q99685 | 1/20 | 0.30 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.30 |
| ▸ | PGR | P06401 | 1/20 | 0.30 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.30 |
| ▸ | PAM | P19021 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8744114 | 1.00 | TSHR (0.39) | TSHRALDH1A1DGKAMGLLNR1I2 | |
| SCHEMBL8744176 | 0.90 | TSHR (0.47) | TSHRALDH1A1DGKAMGLLNR1I2 | |
| SCHEMBL8744182 | 0.90 | TSHR (0.47) | TSHRALDH1A1DGKAMGLLNR1I2 | |
| SCHEMBL8744248 | 0.85 | TSHR (0.37) | TSHRALDH1A1 | |
| SCHEMBL8744251 | 0.85 | TSHR (0.37) | TSHRALDH1A1 | |
| SCHEMBL8744187 | 0.84 | ALDH1A1 (0.52) | TSHRALDH1A1DGKAMGLLNR1I2 | |
| SCHEMBL12662617 | 0.84 | ALDH1A1 (0.52) | TSHRALDH1A1DGKAMGLLNR1I2 | |
| SCHEMBL8744185 | 0.84 | ALDH1A1 (0.52) | TSHRALDH1A1DGKAMGLLNR1I2 | |
| SCHEMBL28158347 | 0.79 | ALDH1A1 (0.46) | TSHRALDH1A1DGKAMGLLNR1I2 | |
| SCHEMBL8744220 | 0.77 | TSHR (0.39) | TSHRALDH1A1PGR |
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-0612720-B1 | Process for producing 1,4-dicyano-2-butene | SUMITOMO CHEMICAL CO (JP) | 1997-01-08 | — | — | EP | disclosed |
| US-5463103-A | Reacting butene derivative with hydrogen cyanide in presence of catalyst prepared from cuprous halide, lower alkylamine hydrohalide and Lewis acid or basic acetate, carbonate or bicarbonate | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1995-10-31 | — | — | US | disclosed |
| EP-0612720-A1 | Process for producing 1,4-dicyano-2-butene | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1994-08-31 | — | — | EP | disclosed |