Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 8/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.39 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 6/20 | 0.37 |
| ▸ | PIP5K1C | O60331 | 1/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL19418574 | 0.88 | EPHX2 (0.44) | EPHX2MAPK10MAPK8MAPK14CYP2C9 | |
| SCHEMBL13159675 | 0.88 | EPHX2 (0.44) | EPHX2MAPK10MAPK8MAPK14CYP2C9 | |
| SCHEMBL14865420 | 0.85 | HTR1A (0.41) | EPHX2HTR1ADRD2DRD4PTGS2 | |
| SCHEMBL13159905 | 0.84 | HTR1A (0.42) | EPHX2HTR1ADRD2DRD4PTGS2 | |
| SCHEMBL13159815 | 0.83 | MAPK10 (0.45) | EPHX2MAPK10MAPK8MAPK14P2RX7 | |
| SCHEMBL19418448 | 0.83 | MAPK10 (0.45) | EPHX2MAPK10MAPK8MAPK14P2RX7 | |
| SCHEMBL19418459 | 0.82 | EPHX2 (0.42) | EPHX2MAPK10MAPK8MAPK14P2RX7 | |
| SCHEMBL14865443 | 0.82 | EPHX2 (0.42) | EPHX2MAPK10MAPK8MAPK14P2RX7 | |
| SCHEMBL13160246 | 0.81 | HTR1A (0.40) | EPHX2HTR1ADRD2DRD4MAPK10 | |
| SCHEMBL2804924 | 0.76 | PTGS2 (0.42) | PTGS2P2RX7 |
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-2401256-B1 | Compounds as bradykinin B1 antagonists | BOEHRINGER INGELHEIM INT (DE) | 2013-04-17 | — | — | EP | disclosed |
| WO-2010097372-A1 | COMPOUNDS AS BRADYKININ B1 ANTAGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-09-02 | — | — | WO | disclosed |