Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 14/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 9/20 | 0.52 |
| ▸ | PTGES | O14684 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 4/20 | 0.41 |
| ▸ | CA2 | P00918 | 4/20 | 0.41 |
| ▸ | CA9 | Q16790 | 4/20 | 0.41 |
| ▸ | CA12 | O43570 | 3/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.40 |
| ▸ | PDE5A | O76074 | 1/20 | 0.40 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.40 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CA3 | P07451 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8933831 | 0.84 | PTGS2 (0.67) | PTGS2PTGS1PTGESCA1CA2 | |
| SCHEMBL6410104 | 0.82 | PTGS2 (0.54) | PTGS2PTGS1PTGESCA1CA2 | |
| SCHEMBL8933926 | 0.80 | PTGS2 (0.73) | PTGS2PTGS1CA1CA2CA9 | |
| SCHEMBL8933928 | 0.73 | PTGS2 (0.67) | PTGS2PTGS1 | |
| SCHEMBL8933854 | 0.73 | PTGS2 (0.69) | PTGS2PTGS1CA1CA2CA9 | |
| SCHEMBL8934192 | 0.72 | PTGS2 (0.56) | PTGS2PTGS1PDPK1 | |
| SCHEMBL8735027 | 0.72 | PTGS2 (0.59) | PTGS2PTGS1 | |
| SCHEMBL8934174 | 0.72 | PTGS2 (0.64) | PTGS2PTGS1ABCB11 | |
| SCHEMBL8765285 | 0.71 | PTGS2 (0.60) | PTGS2PTGS1PTGESCA1CA2 | |
| SCHEMBL6344383 | 0.71 | PTGS2 (0.56) | PTGS2PTGS1CA1CA2CA9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996009304-A1 | BENZOPYRANOPYRAZOLYL DERIVATIVES FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1996-03-28 | — | — | WO | claimed |
| WO-1996009304-A1 | BENZOPYRANOPYRAZOLYL DERIVATIVES FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1996-03-28 | — | — | WO | disclosed |