Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.36 |
| ▸ | RARG | P13631 | 1/20 | 0.36 |
| ▸ | RXRA | P19793 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.34 |
| ▸ | IKBKB | O14920 | 1/20 | 0.34 |
| ▸ | GSK3A | P49840 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL690623 | 0.85 | RARG (0.41) | ALDH1A1RARGRXRAPPARGL3MBTL1 | |
| SCHEMBL5110575 | 0.84 | ALDH1A1 (0.37) | ALDH1A1MAPK14RARGRXRAPPARG | |
| SCHEMBL690060 | 0.80 | MAPK14 (0.53) | MAPK14 | |
| SCHEMBL688392 | 0.80 | MAPK14 (0.38) | ALDH1A1MAPK14RARGRXRAPPARG | |
| SCHEMBL1404705 | 0.80 | RARG (0.38) | ALDH1A1RARGRXRAPPARGL3MBTL1 | |
| SCHEMBL28942237 | 0.79 | CA1 (0.38) | ALDH1A1MAPK14GSK3ACA1CA2 | |
| Hydrochloric Acid SCHEMBL689965 | 0.79 | MAPK14 (0.52) | MAPK14 | |
| SCHEMBL689481 | 0.78 | CA1 (0.37) | ALDH1A1MAPK14L3MBTL1GSK3ACA1 | |
| SCHEMBL15743698 | 0.77 | ALDH1A1 (0.37) | ALDH1A1MAPK14L3MBTL1GSK3ACA1 | |
| SCHEMBL690167 | 0.76 | MAPT (0.38) | ALDH1A1MAPK14RARGRXRAPPARG |
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-2323980-B1 | 7-(PIPERAZINE-1-YMETHYL)-1H-INDOLE-2-CARBOXYLIC ACID (PHENYL)-AMIDE DERIVATIVES AND ALLIED COMPOUNDS AS P38 MAP KINASE INHIBITORS FOR THE TREATMENT OF RESPIRATORY DISEASES | BOEHRINGER INGELHEIM INT (DE) | 2012-02-29 | — | — | EP | claimed |