Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK8 | P45983 | 2/20 | 0.47 |
| ▸ | MAPK9 | P45984 | 2/20 | 0.47 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.44 |
| ▸ | KLKB1 | P03952 | 2/20 | 0.42 |
| ▸ | KLK1 | P06870 | 1/20 | 0.42 |
| ▸ | HPGDS | O60760 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ERN1 | O75460 | 1/20 | 0.38 |
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8198357 | 0.91 | CNR1 (0.52) | MAPK8MAPK9HPGDSCNR1ROCK1 | |
| SCHEMBL8198360 | 0.90 | ECE1 (0.46) | MAPK8MAPK9ACVR1KLKB1KLK1 | |
| SCHEMBL8205711 | 0.90 | SMN1; SMN2 (0.44) | MAPK8MAPK9HPGDSCNR1HPGD | |
| SCHEMBL8207782 | 0.88 | CA1 (0.49) | MAPK8MAPK9KLKB1KLK1CA1 | |
| SCHEMBL12853347 | 0.87 | MAPK8 (0.49) | MAPK8MAPK9HPGDSMAPK10SCN9A | |
| SCHEMBL12853349 | 0.87 | MAPK8 (0.51) | MAPK8MAPK9CA1CA2MAPK10 | |
| SCHEMBL8212490 | 0.85 | CA1 (0.46) | MAPK8MAPK9KLKB1KLK1CA1 | |
| SCHEMBL8206930 | 0.84 | MMP13 (0.46) | MAPK8MAPK9HPGDSCNR1ROCK2 | |
| SCHEMBL8212427 | 0.84 | SMN1; SMN2 (0.41) | MAPK8MAPK9HPGDSCNR1ROCK2 | |
| SCHEMBL8209069 | 0.84 | CNR2 (0.47) | CNR1 |
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-2008082487-A2 | NOVEL JNK INHIBITORS | SCHERING CORPORATION (US) | 2008-07-10 | — | — | WO | disclosed |