Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.46 |
| ▸ | CA9 | Q16790 | 3/20 | 0.46 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | SCN10A | Q9Y5Y9 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5041539 | 0.92 | NTRK1 (0.43) | — | |
| SCHEMBL5035086 | 0.89 | CA2 (0.51) | CA2CA9CA12CA1 | |
| SCHEMBL5039162 | 0.86 | CA12 (0.47) | CA2CA9CA12CA1 | |
| SCHEMBL5045003 | 0.85 | CA12 (0.52) | CA2CA9CA12CA1SCN10A | |
| SCHEMBL5035278 | 0.85 | CA2 (0.44) | CA2CA9CA12CA1 | |
| SCHEMBL5034992 | 0.84 | MAPK1 (0.52) | CA2CA9CA12CA1 | |
| SCHEMBL5036088 | 0.83 | CA12 (0.42) | CA2CA9CA12CA1SCN10A | |
| SCHEMBL5035097 | 0.80 | LMNA (0.43) | CA2CA9CA12CA1SCN10A | |
| SCHEMBL5039198 | 0.79 | CA2 (0.48) | CA2CA9CA12CA1 | |
| SCHEMBL5035279 | 0.78 | HPGD (0.46) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1761541-B1 | PYRRAZOLO-PYRIMIDINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2008-01-09 | — | — | EP | claimed |