Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP2K1 | Q02750 | 4/20 | 0.33 |
| ▸ | MAP2K2 | P36507 | 2/20 | 0.33 |
| ▸ | CA3 | P07451 | 1/20 | 0.30 |
| ▸ | CA6 | P23280 | 1/20 | 0.30 |
| ▸ | CA5A | P35218 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.30 |
| ▸ | CA5B | Q9Y2D0 | 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 | |
|---|---|---|---|---|
| SCHEMBL17366292 | 0.82 | MAP2K2 (0.33) | MAP2K1MAP2K2 | |
| SCHEMBL13863241 | 0.76 | CA9 (0.48) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL21791937 | 0.74 | ALDH1A1 (0.36) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL17366279 | 0.73 | IDO1 (0.30) | — | |
| SCHEMBL29481423 | 0.69 | — | — | |
| SCHEMBL80458 | 0.69 | — | — | |
| SCHEMBL1477169 | 0.69 | — | — | |
| SCHEMBL13692552 | 0.68 | CPS1 (0.40) | CA9CA14 | |
| Fluoride SCHEMBL25169957 | 0.67 | CES2 (0.39) | MAP2K1MAP2K2CA3CA6CA5A | |
| SCHEMBL3880085 | 0.67 | — | — |
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-2399584-A1 | Boronic acids and esters as inhibitors of fatty acid amide hydrolase | Infinity Pharmaceuticals, Inc. (US) | 2011-12-28 | — | — | EP | disclosed |
| WO-2011025565-A1 | MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS | MOCHIDA PHARMACEUTICAL CO., LTD. (JP) | 2011-03-03 | — | — | WO | disclosed |