Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.48 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.45 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.45 |
| ▸ | CPT1A | P50416 | 2/20 | 0.44 |
| ▸ | CPT1B | Q92523 | 2/20 | 0.44 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.44 |
| ▸ | FBP1 | P09467 | 6/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 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 | |
|---|---|---|---|---|
| SCHEMBL9813753 | 0.84 | HDAC1 (0.64) | HDAC1HDAC8TBXA2RALDH1A1HPGD | |
| SCHEMBL3250400 | 0.83 | TBXA2R (0.62) | HDAC1HDAC8TBXA2RALDH1A1HPGD | |
| SCHEMBL9813803 | 0.81 | POLB (0.54) | HDAC1HDAC8HPGDCYP3A4CYP2D6 | |
| SCHEMBL10583477 | 0.80 | ALDH1A1 (0.50) | HDAC1HDAC8ALDH1A1HPGDHSD17B10 | |
| SCHEMBL9813790 | 0.80 | HDAC1 (0.47) | HDAC1HDAC8TBXA2RALDH1A1HPGD | |
| SCHEMBL10581074 | 0.80 | HDAC1 (0.58) | HDAC1HDAC8TBXA2RALDH1A1HPGD | |
| SCHEMBL10584188 | 0.79 | TBXA2R (0.60) | HDAC1HDAC8TBXA2RALDH1A1HPGD | |
| SCHEMBL9813464 | 0.78 | PTGES (0.53) | HDAC1HDAC8ALDH1A1HPGDHSD17B10 | |
| SCHEMBL10583129 | 0.78 | TBXA2R (0.52) | HDAC1HDAC8TBXA2RALDH1A1GAA | |
| SCHEMBL10580163 | 0.77 | TBXAS1 (0.54) | HDAC1HDAC8PTGDR2 |
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-0301421-B1 | SULFUR COMPOUNDS, PROCESS FOR THEIR PREPARATION AND MEDICINES | Roche Diagnostics GmbH (DE) | 1991-08-28 | — | — | EP | claimed |
| EP-0301421-B1 | SULFUR COMPOUNDS, PROCESS FOR THEIR PREPARATION AND MEDICINES | Roche Diagnostics GmbH (DE) | 1991-08-28 | — | — | EP | disclosed |
| EP-0301421-A2 | Sulfur compounds, process for their preparation and medicines | Roche Diagnostics GmbH (DE) | 1989-02-01 | — | — | EP | disclosed |