Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.50 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.47 |
| ▸ | FEN1 | P39748 | 2/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.46 |
| ▸ | HPGD | P15428 | 4/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2704545 | 0.86 | ALOX5AP (0.48) | PTGS2ALOX5APFEN1KDM4EHPGD | |
| SCHEMBL2445897 | 0.85 | ALOX5AP (0.47) | PTGS2ALOX5APFEN1CYP3A4CYP2C9 | |
| SCHEMBL6901981 | 0.78 | PTGS2 (0.68) | PTGS2ALOX5APFEN1PTGS1KDM4E | |
| SCHEMBL250146 | 0.77 | PTGS2 (0.56) | PTGS2PTGS1KDM4EHPGDCYP3A4 | |
| SCHEMBL2703944 | 0.77 | ALOX5AP (0.46) | PTGS2ALOX5APFEN1KDM4EHPGD | |
| SCHEMBL4202592 | 0.75 | PTGS2 (0.55) | PTGS2PTGS1KDM4EHPGDCYP3A4 | |
| SCHEMBL8766886 | 0.75 | ALDH1A1 (0.44) | KDM4ECYP3A4CYP2C19MAPTPOLB | |
| SCHEMBL4629540 | 0.75 | ALOX5AP (0.50) | ALOX5APFEN1HPGD | |
| SCHEMBL4629650 | 0.74 | ALOX5AP (0.52) | ALOX5APFEN1 | |
| SCHEMBL28362934 | 0.74 | PTGS2 (0.68) | PTGS2ALOX5APFEN1PTGS1KDM4E |
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-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 |