Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.34 |
| ▸ | CES2 | O00748 | 2/20 | 0.34 |
| ▸ | ACHE | P22303 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | EP300 | Q09472 | 1/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7294604 | 0.91 | PDE4A (0.39) | GAACES2ACHEALDH1A1RECQL | |
| SCHEMBL7292065 | 0.90 | HTT (0.37) | GAACES2ACHEALDH1A1SMN1; SMN2 | |
| SCHEMBL7291459 | 0.90 | CNR2 (0.36) | CES2ACHESMN1; SMN2PDE4APDE4B | |
| SCHEMBL10569584 | 0.89 | KDM4E (0.38) | ALDH1A1RECQLPDE4APDE4BPDE4C | |
| SCHEMBL7289330 | 0.89 | MIF (0.34) | ACHEPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7286210 | 0.89 | GABRP (0.41) | ACHEALDH1A1SMN1; SMN2PDE4APDE4B | |
| SCHEMBL10561260 | 0.88 | ACHE (0.36) | GAACES2ACHEALDH1A1RECQL | |
| SCHEMBL7286216 | 0.86 | IDO1 (0.34) | PDE4APDE4BPDE4CPDE4DMAPT | |
| SCHEMBL7290542 | 0.86 | MAPT (0.41) | GAACES2ACHEALDH1A1SMN1; SMN2 | |
| SCHEMBL10570971 | 0.85 | MAPT (0.45) | GAAALDH1A1SMN1; SMN2MEN1MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0281045-B1 | BENZOTHIEPINO (5,4-C) PYRIDAZINE COMPOUNDS AND THEIR PHARMACEUTICAL USES | Yoshitomi Pharmaceutical Industries, Ltd. (JP) | 1991-12-27 | — | — | EP | claimed |
| EP-0281045-A1 | Benzothiepino (5,4-c) pyridazine compounds and their pharmaceutical uses | Yoshitomi Pharmaceutical Industries, Ltd. (JP) | 1988-09-07 | — | — | EP | disclosed |