Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 11/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 6/20 | 0.39 |
| ▸ | CDYL2 | Q8N8U2 | 1/20 | 0.37 |
| ▸ | CDYL | Q9Y232 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | NQO2 | P16083 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7412970 | 0.81 | EGFR (0.39) | CDYL2CDYLALDH1A1NQO2MEN1 | |
| SCHEMBL7436029 | 0.80 | PGR (0.45) | GSK3BPTPN1CDYL2CDYLNQO2 | |
| SCHEMBL7423124 | 0.80 | ALDH1A1 (0.37) | ALDH1A1NQO2MEN1KMT2A | |
| SCHEMBL29003160 | 0.75 | EPHX2 (0.38) | GSK3BPTPN1ALDH1A1MEN1KMT2A | |
| SCHEMBL6906468 | 0.72 | CA1 (0.44) | ALDH1A1TDP1MEN1KMT2A | |
| SCHEMBL7379731 | 0.72 | CDYL2 (0.47) | GSK3BCDYL2CDYLNQO2 | |
| SCHEMBL7418793 | 0.69 | PDE3B (0.49) | GSK3BPTPN1 | |
| SCHEMBL17713638 | 0.69 | EPHX2 (0.39) | GSK3BPTPN1MEN1KMT2A | |
| SCHEMBL2224458 | 0.67 | GSK3B (0.46) | GSK3BPTPN1 | |
| SCHEMBL7307647 | 0.67 | MAPK14 (0.52) | GSK3BPTPN1ALDH1A1 |
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-0247167-A4 | HYDROXY AND AMINOTHIAZOLYL-BENZODIAZINONE COMPOUNDS, CARDIOTONIC COMPOSITIONS INCLUDING THE SAME, AND THEIR USES. | RORER INTERNAT OVERSEAS INC (US) | 1988-12-12 | — | — | EP | disclosed |
| EP-0247167-A1 | HYDROXY AND AMINOTHIAZOLYL-BENZODIAZINONE COMPOUNDS, CARDIOTONIC COMPOSITIONS INCLUDING THE SAME, AND THEIR USES | RORER INTERNATIONAL (OVERSEAS) INC. (a Delaware corporation) (US) | 1987-12-02 | — | — | EP | disclosed |
| WO-1987003199-A1 | HYDROXY AND AMINOTHIAZOLYL-BENZODIAZINONE COMPOUNDS, CARDIOTONIC COMPOSITIONS INCLUDING THE SAME, AND THEIR USES | RORER INTERNATIONAL (OVERSEAS) INC. (US) | 1987-06-04 | — | — | WO | disclosed |