Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | NAAA | Q02083 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | WRN | Q14191 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8744251 | 1.00 | TSHR (0.37) | TSHRNAAAALDH1A1CYP1A2HPGD | |
| SCHEMBL8744108 | 0.85 | TSHR (0.39) | TSHRALDH1A1 | |
| SCHEMBL8744114 | 0.85 | TSHR (0.39) | TSHRALDH1A1 | |
| SCHEMBL19999909 | 0.85 | MCL1 (0.35) | TSHRNAAAALDH1A1CYP1A2HPGD | |
| SCHEMBL8744195 | 0.83 | NAAA (0.44) | TSHRNAAAALDH1A1CYP1A2HPGD | |
| SCHEMBL11292223 | 0.83 | NAAA (0.44) | TSHRNAAAALDH1A1CYP1A2HPGD | |
| SCHEMBL8744192 | 0.83 | NAAA (0.44) | TSHRNAAAALDH1A1CYP1A2HPGD | |
| SCHEMBL8744182 | 0.82 | TSHR (0.47) | TSHRALDH1A1MEN1KMT2A | |
| SCHEMBL8744176 | 0.82 | TSHR (0.47) | TSHRALDH1A1MEN1KMT2A | |
| SCHEMBL8744220 | 0.80 | TSHR (0.39) | TSHRALDH1A1 |
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 |