Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 3/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | EPAS1 | Q99814 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TTR | P02766 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.38 |
| ▸ | CBR1 | P16152 | 1/20 | 0.38 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.38 |
| ▸ | AGTR1 | P30556 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29845834 | 0.83 | TTR (0.56) | SLC6A2SLC6A3SLC6A4MAPK1ALDH1A1 | |
| SCHEMBL15067155 | 0.83 | EPAS1 (0.55) | MAPK1ALDH1A1L3MBTL1TDP1EPAS1 | |
| SCHEMBL29533442 | 0.83 | EPAS1 (0.55) | MAPK1ALDH1A1L3MBTL1TDP1EPAS1 | |
| SCHEMBL7186654 | 0.80 | ALDH1A1 (0.58) | MAPK1ALDH1A1L3MBTL1TDP1HPGD | |
| SCHEMBL21186385 | 0.79 | SLC6A2 (0.47) | SLC6A2SLC6A3SLC6A4MAPK1ALDH1A1 | |
| SCHEMBL21186018 | 0.78 | PDE7A (0.47) | SLC6A2SLC6A3SLC6A4ALDH1A1HPGD | |
| SCHEMBL21186209 | 0.78 | PDE7A (0.56) | SLC6A2SLC6A3SLC6A4ALDH1A1TDP1 | |
| SCHEMBL31264488 | 0.78 | PDE7A (0.56) | SLC6A2SLC6A3SLC6A4ALDH1A1TDP1 | |
| SCHEMBL1471874 | 0.78 | MEN1 (0.45) | MAPK1ALDH1A1L3MBTL1TDP1EPAS1 | |
| SCHEMBL1333707 | 0.77 | CA1 (0.52) | SLC6A2SLC6A3SLC6A4HPGDNR1I2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019141980-A1 | AGRICULTURAL CHEMICALS | GLOBACHEM NV (BE) | 2019-07-25 | — | — | WO | disclosed |
| WO-2018086604-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATIONS THEREOF | 山东罗欣药业集团股份有限公司 | 2018-05-17 | — | — | WO | disclosed |