Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.38 |
| ▸ | PTGES | O14684 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 11/20 | 0.35 |
| ▸ | CA1 | P00915 | 7/20 | 0.35 |
| ▸ | CA7 | P43166 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 3/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14163058 | 0.91 | PTGS2 (0.38) | PTGS2PTGESCA2CA1CA7 | |
| SCHEMBL14163144 | 0.91 | PTGS2 (0.38) | PTGS2PTGESCA2CA1CA7 | |
| SCHEMBL3113686 | 0.91 | PTGS2 (0.38) | PTGS2PTGESCA2CA1CA7 | |
| SCHEMBL3111940 | 0.89 | PTGS2 (0.40) | PTGS2PTGESCA2CA1CA7 | |
| SCHEMBL14163110 | 0.87 | PTGS2 (0.37) | PTGS2PTGESCA2CA1CA7 | |
| SCHEMBL13099721 | 0.86 | CA2 (0.37) | PTGS2PTGESCA2CA1HTT | |
| SCHEMBL14163119 | 0.86 | PTGS2 (0.42) | PTGS2PTGESCA2CA1CA7 | |
| SCHEMBL14163078 | 0.86 | PTGS2 (0.36) | PTGS2PTGESCA2CA1CA7 | |
| SCHEMBL13099719 | 0.86 | CA2 (0.38) | PTGS2PTGESCA2CA1CA9 | |
| SCHEMBL4851340 | 0.85 | PTGS2 (0.38) | PTGS2PTGESCA2CA1CA7 |
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-2008075152-A1 | 1- [4- (SULFONYL) -PHENYL] -5- (BENZYL) -IH-I, 2, 4-TRIAZOL DERIVATIVES AS INHIBITORS OF CARBONIC ANHYDRASE FOR TREATING GLAUCOMA OR OCULAR HYPERTENSION | PFIZER PRODUCTS INC. (US) | 2008-06-26 | — | — | WO | disclosed |