Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 6/20 | 0.37 |
| ▸ | PTGES | O14684 | 3/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 4/20 | 0.34 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.34 |
| ▸ | MAPK9 | P45984 | 2/20 | 0.34 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.34 |
| ▸ | RAF1 | P04049 | 1/20 | 0.34 |
| ▸ | JAK1 | P23458 | 2/20 | 0.34 |
| ▸ | JAK3 | P52333 | 2/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2809565 | 0.89 | P2RX7 (0.37) | P2RX7PTGESPTGS2CNR2MAPK8 | |
| SCHEMBL14865294 | 0.88 | P2RX7 (0.36) | P2RX7PTGESCNR2MAPK9MAPK10 | |
| SCHEMBL2810139 | 0.85 | BDKRB1 (0.36) | P2RX7PTGESPTGS2CNR2MAPK8 | |
| SCHEMBL185877 | 0.83 | P2RX7 (0.36) | P2RX7PTGESPTGS2CNR2MAPK8 | |
| SCHEMBL2806537 | 0.83 | P2RX7 (0.34) | P2RX7PTGESCNR2MAPK8MAPK9 | |
| SCHEMBL2809935 | 0.82 | BDKRB1 (0.38) | P2RX7PTGESCNR2RAF1KCNH2 | |
| SCHEMBL2807071 | 0.82 | BDKRB1 (0.35) | P2RX7PTGESCNR2MAPK8MAPK9 | |
| SCHEMBL185684 | 0.82 | BDKRB1 (0.35) | P2RX7PTGESCNR2MAPK8MAPK9 | |
| SCHEMBL185693 | 0.81 | FGFR4 (0.33) | P2RX7PTGESJAK1JAK3JAK2 | |
| SCHEMBL14857218 | 0.81 | MAPK7 (0.32) | P2RX7PTGESCNR2MAPK10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2401256-B1 | Compounds as bradykinin B1 antagonists | BOEHRINGER INGELHEIM INT (DE) | 2013-04-17 | — | — | EP | disclosed |