Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | SCN5A | Q14524 | 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 | |
|---|---|---|---|---|
| SCHEMBL7808328 | 0.92 | NR1I2 (0.42) | NR1I2F2ADORA3SLC6A2AGTR1 | |
| SCHEMBL6563280 | 0.84 | NQO2 (0.35) | F2 | |
| SCHEMBL6563585 | 0.77 | F2 (0.40) | F2 | |
| SCHEMBL6565382 | 0.76 | — | — | |
| SCHEMBL7806876 | 0.76 | NR1I2 (0.34) | NR1I2F2ADORA3SLC6A2AGTR1 | |
| SCHEMBL6562044 | 0.75 | NQO2 (0.37) | F2 | |
| SCHEMBL7806909 | 0.75 | ALDH1A1 (0.39) | NR1I2F2ADORA3SLC6A2AGTR1 | |
| SCHEMBL7806863 | 0.74 | HRH3 (0.35) | NR1I2F2ADORA3SLC6A2AGTR1 | |
| SCHEMBL6563633 | 0.74 | NQO2 (0.37) | F2 | |
| SCHEMBL6565357 | 0.74 | F2 (0.37) | F2 |
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-1140802-A1 | SUBSTITUTED ARYL AND HETEROARYL DERIVATIVES, THEIR PRODUCTION AND THEIR USE AS MEDICINES | BOEHRINGER INGELHEIM KG (DE) | 2001-10-10 | — | — | EP | disclosed |
| WO-2000035859-A1 | SUBSTITUTED ARYL AND HETEROARYL DERIVATIVES, THEIR PRODUCTION AND THEIR USE AS MEDICINES | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2000-06-22 | — | — | WO | disclosed |