Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP2 | O95551 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.32 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.31 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20951663 | 0.80 | CA1 (0.43) | TDP2ALDH1A1CA1CA2CA7 | |
| SCHEMBL5288032 | 0.72 | MAPK14 (0.56) | ALDH1A1MAPK14 | |
| SCHEMBL2390689 | 0.71 | ACHE (0.46) | TDP2ALDH1A1CA1CA2CA7 | |
| SCHEMBL14430335 | 0.67 | HTT (0.33) | GRM1 | |
| SCHEMBL12310527 | 0.66 | METAP1 (0.44) | ALDH1A1CA1CA2CA7CA9 | |
| SCHEMBL9589413 | 0.65 | SRD5A1 (0.45) | CA1CA2CA7CA9MALT1 | |
| SCHEMBL10908106 | 0.65 | CA1 (0.41) | TDP2ALDH1A1CA1CA2CA7 | |
| SCHEMBL14430356 | 0.65 | ABCC9 (0.32) | GRM1 | |
| SCHEMBL30701788 | 0.65 | ABCC9 (0.32) | GRM1 | |
| SCHEMBL5293741 | 0.65 | MAPK14 (0.58) | MAPK14 |
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-2007000337-A1 | BICYCLIC DERIVATIVES AS P38 KINASE INHIBITORS | PALAU PHARMA, S.A. (ES) | 2007-01-04 | — | — | WO | disclosed |