Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 13/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.46 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.46 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.45 |
| ▸ | GSR | P00390 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL13495638 | 0.88 | PTGS2 (0.47) | PTGS2PTGS1POLBALDH3A1GSR | |
| SCHEMBL13495696 | 0.86 | NR1H2 (0.61) | NR1H2NR1H3ALDH3A1 | |
| SCHEMBL13495644 | 0.86 | HTT (0.48) | PTGS2POLBNR1H2NR1H3ALDH3A1 | |
| SCHEMBL13495634 | 0.86 | POLB (0.44) | PTGS2POLBALDH3A1GSR | |
| SCHEMBL13495645 | 0.83 | POLB (0.41) | POLBNR1H2NR1H3ALDH3A1GSR | |
| SCHEMBL13495667 | 0.83 | GLA (0.48) | PTGS2PTGS1NR1H2NR1H3ALDH3A1 | |
| SCHEMBL13495635 | 0.83 | ALDH1A1 (0.43) | POLBALDH3A1GSR | |
| SCHEMBL13495671 | 0.83 | POLB (0.42) | PTGS2POLBALDH3A1GSR | |
| SCHEMBL13495668 | 0.81 | GSR (0.43) | PTGS2PTGS1POLBNR1H2NR1H3 | |
| SCHEMBL13495578 | 0.81 | ATM (0.46) | PTGS2NR1H2NR1H3 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010012745-A2 | BENZIMIDAZOLES | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-02-04 | — | — | WO | disclosed |