Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 11/20 | 0.61 |
| ▸ | CA9 | Q16790 | 11/20 | 0.61 |
| ▸ | CA4 | P22748 | 10/20 | 0.61 |
| ▸ | CA1 | P00915 | 10/20 | 0.61 |
| ▸ | CA12 | O43570 | 6/20 | 0.54 |
| ▸ | CA3 | P07451 | 5/20 | 0.54 |
| ▸ | CA6 | P23280 | 5/20 | 0.54 |
| ▸ | CA5A | P35218 | 5/20 | 0.54 |
| ▸ | CA7 | P43166 | 5/20 | 0.54 |
| ▸ | CA13 | Q8N1Q1 | 5/20 | 0.54 |
| ▸ | CA14 | Q9ULX7 | 5/20 | 0.54 |
| ▸ | CA5B | Q9Y2D0 | 5/20 | 0.54 |
| ▸ | IKBKB | O14920 | 1/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 8/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 6/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL13238794 | 0.76 | PTGS2 (0.47) | CA2CA9CA4CA1CA12 | |
| SCHEMBL6659189 | 0.74 | CCNA2 (0.64) | CA2CA9CA4CA1IKBKB | |
| SCHEMBL14747600 | 0.74 | PTGS2 (0.69) | PTGS2PTGS1 | |
| SCHEMBL3107038 | 0.70 | CA2 (0.65) | CA2CA9CA4CA1CA12 | |
| SCHEMBL6660718 | 0.69 | CA9 (0.55) | CA2CA9CA4CA1CA12 | |
| SCHEMBL6632506 | 0.68 | CA2 (0.50) | CA2CA9CA4CA1CA12 | |
| Hydrochloric Acid SCHEMBL7939254 | 0.65 | PLK4 (0.39) | IKBKB | |
| SCHEMBL8765473 | 0.64 | PTGS2 (0.76) | CA2CA9CA4CA1CA12 | |
| SCHEMBL8764591 | 0.64 | PTGS2 (0.64) | CA2CA9CA4CA1CA12 | |
| SCHEMBL8765113 | 0.64 | PTGS2 (0.62) | CA2CA9CA4CA1PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1476431-A1 | TRICYCLIC PYRAZOLE DERIVATIVES FOR THE TREATMENT OF INFLAMMATION | Pharmacia Corporation (US) | 2004-11-17 | — | — | EP | claimed |
| WO-2003070706-A1 | TRICYCLIC PYRAZOLE DERIVATIVES FOR THE TREATMENT OF INFLAMMATION | PHARMACIA CORPORATION (US) | 2003-08-28 | — | — | WO | claimed |