Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | CPB1 | P15086 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.46 |
| ▸ | CTSL | P07711 | 1/20 | 0.45 |
| ▸ | CTSB | P07858 | 1/20 | 0.45 |
| ▸ | CTSK | P43235 | 1/20 | 0.45 |
| ▸ | TLR4 | O00206 | 1/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9533915 | 0.84 | ALDH1A1 (0.50) | ALDH1A1GAACPB1TSHREPHX1 | |
| SCHEMBL9533919 | 0.84 | ALDH1A1 (0.50) | ALDH1A1GAACPB1TSHREPHX1 | |
| SCHEMBL10429964 | 0.84 | ALDH1A1 (0.50) | ALDH1A1GAACPB1TSHREPHX1 | |
| SCHEMBL9873970 | 0.84 | CPB1 (0.53) | ALDH1A1GAACPB1TSHREPHX1 | |
| SCHEMBL29739737 | 0.83 | ALDH1A1 (0.54) | ALDH1A1GAACPB1TSHREPHX1 | |
| SCHEMBL29739725 | 0.83 | ALDH1A1 (0.54) | ALDH1A1GAACPB1TSHREPHX1 | |
| SCHEMBL9534714 | 0.82 | ALDH1A1 (0.56) | ALDH1A1GAACPB1TSHREPHX1 | |
| SCHEMBL10429972 | 0.81 | CPB1 (0.49) | ALDH1A1GAACPB1 | |
| SCHEMBL29739718 | 0.81 | CPB1 (0.54) | ALDH1A1GAACPB1TSHREPHX1 | |
| SCHEMBL29739843 | 0.81 | CPB1 (0.54) | ALDH1A1GAACPB1TSHREPHX1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0352083-B1 | Alkenyltetrazole derivatives, their preparation and use | SHIONOGI & CO (JP) | 1993-11-24 | — | — | EP | disclosed |
| EP-0384747-A1 | Pharmaceutical or veterinary preparations of substituted hexenoic acid derivatives | SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) | 1990-08-29 | — | — | EP | disclosed |
| US-4916231-A | THROMBOXANE A2 RECPTOR ANTAGONISTS | SHIONOGI & CO., LTD. (JP) | 1990-04-10 | — | — | US | disclosed |
| EP-0352083-A2 | Alkenyltetrazole derivatives, their preparation and use | SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) | 1990-01-24 | — | — | EP | disclosed |