Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 3/20 | 0.40 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.40 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.39 |
| ▸ | MMP13 | P45452 | 1/20 | 0.39 |
| ▸ | ERN1 | O75460 | 1/20 | 0.38 |
| ▸ | CTSA | P10619 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 2/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.38 |
| ▸ | CNR1 | P21554 | 2/20 | 0.37 |
| ▸ | PRKD1 | Q15139 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | AVPR1B | P47901 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8206189 | 0.89 | CNR2 (0.52) | CNR2MAPK8MAPK9CTSACNR1 | |
| SCHEMBL8199927 | 0.87 | CNR2 (0.50) | CNR2POLBSMN1; SMN2CNR1 | |
| SCHEMBL8209069 | 0.85 | CNR2 (0.47) | CNR2CTSACNR1AVPR1B | |
| SCHEMBL8205711 | 0.84 | SMN1; SMN2 (0.44) | MAPK8MAPK9CTSASMN1; SMN2CNR1 | |
| SCHEMBL8206930 | 0.84 | MMP13 (0.46) | MAPK8MAPK9ROCK2ROCK1MMP13 | |
| SCHEMBL8212427 | 0.84 | SMN1; SMN2 (0.41) | CNR2MAPK8MAPK9ROCK2ROCK1 | |
| SCHEMBL8198357 | 0.83 | CNR1 (0.52) | MAPK8MAPK9ROCK1CTSAPOLB | |
| SCHEMBL8198360 | 0.83 | ECE1 (0.46) | MAPK8MAPK9ROCK2ROCK1ERN1 | |
| SCHEMBL8205692 | 0.82 | MAPK8 (0.47) | MAPK8MAPK9ROCK2ROCK1ERN1 | |
| SCHEMBL12853352 | 0.82 | CNR2 (0.52) | CNR2MMP13CTSACNR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8278337-B2 | Substituted pyridines that are JNK inhibitors | MERCK SHARP & DOHME (US) | 2012-10-02 | — | — | US | disclosed |