Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 8/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.39 |
| ▸ | ERN1 | O75460 | 1/20 | 0.39 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.37 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6745120 | 0.83 | ACLY (0.35) | PTGS2PTGS1LMNAPOLBALDH1A1 | |
| SCHEMBL6744598 | 0.81 | PTGS2 (0.39) | PTGS2PTGS1 | |
| SCHEMBL6747146 | 0.80 | PTGS2 (0.40) | PTGS2PTGS1CYP17A1CYP11B2LMNA | |
| SCHEMBL6746033 | 0.80 | CYP11B1 (0.38) | PTGS2CYP11B2CYP11B1CYP2A6 | |
| SCHEMBL6746349 | 0.80 | PTGS2 (0.41) | PTGS2PTGS1 | |
| SCHEMBL6745114 | 0.78 | SDHB (0.38) | PTGS2PTGS1AKR1C3AKR1C2 | |
| SCHEMBL8974347 | 0.78 | PTGS2 (0.62) | PTGS2PTGS1 | |
| SCHEMBL6743712 | 0.77 | PTGS2 (0.44) | PTGS2PTGS1CYP3A4CYP1A2 | |
| SCHEMBL6744935 | 0.77 | PTGS2 (0.36) | PTGS2PTGS1 | |
| SCHEMBL6750004 | 0.77 | PTGS2 (0.46) | PTGS2PTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6699884-B2 | ANTIINFLAMMATORY CYCLOOXYGENASE INHIBITORS. | PHARMACIA CORPORATION | 2004-03-02 | — | — | US | claimed |
| US-6699884-B2 | ANTIINFLAMMATORY CYCLOOXYGENASE INHIBITORS. | PHARMACIA CORPORATION | 2004-03-02 | — | — | US | disclosed |