Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 14/20 | 0.40 |
| ▸ | CNR1 | P21554 | 7/20 | 0.40 |
| ▸ | NQO2 | P16083 | 1/20 | 0.40 |
| ▸ | TXK | P42681 | 1/20 | 0.38 |
| ▸ | ITK | Q08881 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.38 |
| ▸ | BCHE | P06276 | 2/20 | 0.38 |
| ▸ | ACSL1 | P33121 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8125952 | 0.88 | NQO2 (0.51) | NQO2 | |
| SCHEMBL8026468 | 0.82 | F2 (0.48) | RORCCNR2CNR1NQO2TXK | |
| SCHEMBL8016095 | 0.80 | F2 (0.48) | CNR2CNR1TXKITKBCHE | |
| SCHEMBL8028963 | 0.79 | F2 (0.53) | CNR2CNR1NQO2OPRM1BCHE | |
| SCHEMBL8028179 | 0.76 | F2 (0.50) | CNR2CNR1NQO2ITKACSL1 | |
| SCHEMBL8117045 | 0.76 | CNR2 (0.40) | RORCCNR2CNR1NQO2OPRM1 | |
| SCHEMBL8030110 | 0.76 | CNR2 (0.45) | CNR2 | |
| SCHEMBL8016085 | 0.76 | F2 (0.47) | CNR2CNR1NQO2TXKITK | |
| SCHEMBL8026759 | 0.74 | CNR2 (0.53) | CNR2CNR1OPRM1BCHE | |
| SCHEMBL8032010 | 0.74 | CNR2 (0.48) | RORCCNR2CNR1BCHEACSL1 |
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-1060166-A1 | FIVE-MEMBERED, BENZO-CONDENSED HETEROCYCLES USED AS ANTITHROMBOTIC AGENTS | Boehringer Ingelheim Pharma KG (DE) | 2000-12-20 | — | — | EP | disclosed |
| WO-1999040072-A1 | FIVE-MEMBERED, BENZO-CONDENSED HETEROCYCLES USED AS ANTITHROMBOTIC AGENTS | BOEHRINGER INGELHEIM PHARMA KG (DE) | 1999-08-12 | — | — | WO | disclosed |