Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | APP | P05067 | 2/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.42 |
| ▸ | GSK3B | P49841 | 2/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.39 |
| ▸ | WNT3A | P56704 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7423796 | 0.88 | ADORA3 (0.55) | ADORA3KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL14072437 | 0.80 | ADORA3 (0.68) | ADORA3KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL13995844 | 0.79 | ADORA3 (0.61) | ADORA3KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL17753301 | 0.79 | ADORA3 (0.61) | ADORA3KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL17753303 | 0.79 | ADORA3 (0.61) | ADORA3KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL11487364 | 0.76 | ADORA3 (0.58) | ADORA3KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL29033598 | 0.76 | ADORA3 (0.62) | ADORA3KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL8198639 | 0.76 | ADORA3 (0.61) | ADORA3KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL31295133 | 0.76 | CTNNB1 (0.65) | KDM4EALDH1A1HSD17B10CTNNB1WNT3A | |
| SCHEMBL220455 | 0.76 | CTNNB1 (0.65) | KDM4EALDH1A1HSD17B10CTNNB1WNT3A |
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 |