Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 10/20 | 0.68 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.65 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.60 |
| ▸ | CA9 | Q16790 | 3/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | CA1 | P00915 | 1/20 | 0.55 |
| ▸ | CA2 | P00918 | 1/20 | 0.55 |
| ▸ | CA4 | P22748 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL8420932 | 0.92 | PTGS2 (0.59) | CHRNA7PTGS2PTGS1CA9CYP2C9 | |
| SCHEMBL8119795 | 0.91 | CHRNA7 (0.75) | CHRNA7PTGS2PTGS1CA9SMN1; SMN2 | |
| SCHEMBL9253143 | 0.90 | PTGS2 (0.66) | CHRNA7PTGS2PTGS1CA9CYP2C9 | |
| SCHEMBL8126446 | 0.87 | SMN1; SMN2 (0.70) | CHRNA7PTGS2PTGS1CA9CYP2C9 | |
| SCHEMBL8120201 | 0.86 | PTGS2 (0.66) | CHRNA7PTGS2PTGS1CYP2C9SMN1; SMN2 | |
| SCHEMBL8119257 | 0.83 | PTGS2 (0.67) | CHRNA7PTGS2PTGS1CYP2C9SMN1; SMN2 | |
| SCHEMBL8119016 | 0.83 | PTGS2 (0.72) | CHRNA7PTGS2PTGS1CYP2C9SMN1; SMN2 | |
| SCHEMBL8423687 | 0.82 | PTGS2 (0.66) | CHRNA7PTGS2PTGS1CA9SMN1; SMN2 | |
| SCHEMBL8422291 | 0.81 | PTGS2 (0.62) | PTGS2PTGS1CA9SMN1; SMN2CA1 | |
| SCHEMBL8118945 | 0.81 | PTGS2 (0.73) | CHRNA7PTGS2PTGS1CYP2C9 |
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-5908852-A | 1,3,5 trisubstituted pyrazole compounds for treatment of inflammation | G. D. SEARLE & CO. (US) | 1999-06-01 | — | — | US | disclosed |
| US-5434178-A | 1,3,5 trisubstituted pyrazole compounds for treatment of inflammation | G.D. SEARLE & CO. (US) | 1995-07-18 | — | — | US | disclosed |