Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP2 | P50579 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL689520 | 0.81 | ADRB3 (0.38) | KDM4EPOLBSMN1; SMN2HSD17B10MAPK14 | |
| SCHEMBL690158 | 0.76 | ADRB3 (0.39) | KDM4ESMN1; SMN2HSD17B10MAPK14ALDH1A1 | |
| SCHEMBL689060 | 0.74 | ADRB3 (0.39) | KDM4ESMN1; SMN2HSD17B10MAPK14ALDH1A1 | |
| SCHEMBL690060 | 0.74 | MAPK14 (0.53) | MAPK14 | |
| Hydrochloric Acid SCHEMBL689965 | 0.73 | MAPK14 (0.52) | MAPK14 | |
| SCHEMBL692913 | 0.73 | MAPK14 (0.42) | KDM4ESMN1; SMN2HSD17B10MAPK14ALDH1A1 | |
| SCHEMBL690277 | 0.72 | MAPK14 (0.41) | KDM4ESMN1; SMN2HSD17B10MAPK14ALDH1A1 | |
| SCHEMBL4056748 | 0.72 | MAPK14 (0.37) | KDM4ESMN1; SMN2HSD17B10MAPK14ALDH1A1 | |
| SCHEMBL10753256 | 0.68 | CA12 (0.47) | CA12CA1CA2CA9CA14 | |
| SCHEMBL20921433 | 0.68 | PIK3CD (0.47) | — |
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 |