Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.44 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.44 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.44 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.43 |
| ▸ | KIF11 | P52732 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 4/20 | 0.43 |
| ▸ | MAOB | P27338 | 4/20 | 0.43 |
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.42 |
| ▸ | CRBN | Q96SW2 | 2/20 | 0.40 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 5/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 5/20 | 0.40 |
| ▸ | CDC42 | P60953 | 1/20 | 0.40 |
| ▸ | RAC1 | P63000 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1890344 | 1.00 | CA9 (0.50) | CA9NPC1MAPK13MAPK12MAPK11 | |
| SCHEMBL11574095 | 0.88 | KIF11 (0.52) | NPC1MAPK13MAPK12MAPK11MAPK14 | |
| SCHEMBL1880793 | 0.87 | CA9 (0.53) | CA9NPC1MAPK13MAPK12MAPK11 | |
| SCHEMBL1880791 | 0.87 | CA9 (0.53) | CA9NPC1MAPK13MAPK12MAPK11 | |
| SCHEMBL2218608 | 0.83 | CA9 (0.54) | CA9NPC1MAPK13MAPK12MAPK11 | |
| SCHEMBL29754329 | 0.83 | CA9 (0.57) | CA9NPC1MAPK13MAPK12MAPK11 | |
| SCHEMBL2611058 | 0.83 | CA9 (0.57) | CA9NPC1MAPK13MAPK12MAPK11 | |
| SCHEMBL29337400 | 0.80 | CA9 (0.58) | CA9NPC1MAPK13MAPK12MAPK11 | |
| SCHEMBL24192092 | 0.78 | AHR (0.49) | PTGS1PTGS2SMYD3 | |
| SCHEMBL7037819 | 0.78 | AHR (0.49) | PTGS1PTGS2SMYD3 |
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-1856031-B1 | 2-ARYLPROPIONIC ACID DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | DOMPE PHA R MA SPA RES & MFG (IT) | 2009-02-25 | — | — | EP | disclosed |