Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 12/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.32 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5800364 | 1.00 | PTGS2 (0.38) | PTGS2TSHRABCB11AKR1C3AKR1C2 | |
| SCHEMBL5798228 | 0.95 | PTGS2 (0.40) | PTGS2TSHR | |
| SCHEMBL5809649 | 0.94 | PTGS2 (0.37) | PTGS2AKR1C3AKR1C2KDM4EPOLB | |
| SCHEMBL5809647 | 0.94 | PTGS2 (0.37) | PTGS2AKR1C3AKR1C2KDM4EPOLB | |
| SCHEMBL5800263 | 0.94 | TSHR (0.39) | PTGS2TSHRABCB11AKR1C3AKR1C2 | |
| SCHEMBL5800266 | 0.94 | TSHR (0.39) | PTGS2TSHRABCB11AKR1C3AKR1C2 | |
| SCHEMBL5798896 | 0.90 | PTGS2 (0.45) | PTGS2AKR1C3AKR1C2 | |
| SCHEMBL5798899 | 0.90 | PTGS2 (0.45) | PTGS2AKR1C3AKR1C2 | |
| SCHEMBL5797882 | 0.89 | PTGS2 (0.36) | PTGS2TSHR | |
| SCHEMBL5797881 | 0.89 | PTGS2 (0.36) | PTGS2TSHR |
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-2006050120-A2 | SYNTHESIS OF COX-2 AND FAAH INHIBITORS | MICROBIA, INC. (US) | 2006-05-11 | — | — | WO | disclosed |