Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.60 |
| ▸ | TSHR | P16473 | 3/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | CTSD | P07339 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.42 |
| ▸ | APEX1 | P27695 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2837830 | 0.93 | GPR35 (0.53) | GPR35TSHRALDH1A1CTSDTDP1 | |
| SCHEMBL3671 | 0.88 | TSHR (0.68) | GPR35TSHRALDH1A1CTSDTDP1 | |
| SCHEMBL7263414 | 0.88 | GPR35 (0.60) | GPR35TSHRALDH1A1CTSDTDP1 | |
| SCHEMBL30893562 | 0.88 | TSHR (0.68) | GPR35TSHRALDH1A1CTSDTDP1 | |
| SCHEMBL8962721 | 0.88 | GPR35 (0.51) | GPR35TSHRALDH1A1CTSDTDP1 | |
| SCHEMBL7115179 | 0.88 | GPR35 (0.51) | GPR35TSHRALDH1A1CTSDTDP1 | |
| SCHEMBL1694705 | 0.88 | GPR35 (0.51) | GPR35TSHRALDH1A1CTSDTDP1 | |
| SCHEMBL10824707 | 0.86 | TSHR (0.66) | GPR35TSHRALDH1A1CTSDTDP1 | |
| SCHEMBL16267318 | 0.86 | TSHR (0.66) | GPR35TSHRALDH1A1CTSDTDP1 | |
| SCHEMBL7791983 | 0.86 | TSHR (0.66) | GPR35TSHRALDH1A1CTSDTDP1 |
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 |