Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | PIM1 | P11309 | 1/20 | 0.33 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.33 |
| ▸ | PHGDH | O43175 | 5/20 | 0.31 |
| ▸ | AHR | P35869 | 1/20 | 0.30 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.30 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.30 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4553079 | 0.92 | NR1I2 (0.35) | PHGDH | |
| SCHEMBL4553943 | 0.80 | MAPK8 (0.32) | ROCK2PIM1PIM3MAPK8MAPK9 | |
| SCHEMBL4553080 | 0.78 | PTGS2 (0.34) | — | |
| SCHEMBL4555123 | 0.73 | MAPK8 (0.33) | ROCK2PIM1PIM3PHGDHMAPK8 | |
| SCHEMBL4555121 | 0.73 | MAPK8 (0.35) | ROCK2PIM1PIM3PHGDHMAPK8 | |
| SCHEMBL4554327 | 0.72 | MAPK8 (0.38) | ROCK2PIM1PIM3MAPK8MAPK9 | |
| SCHEMBL5111979 | 0.71 | SMN1; SMN2 (0.41) | ROCK2PIM1PIM3PHGDHMAPK8 | |
| SCHEMBL4553882 | 0.71 | IRAK4 (0.33) | ROCK2PIM1PIM3PHGDHMAPK8 | |
| SCHEMBL4553884 | 0.71 | IRAK4 (0.33) | ROCK2PIM1PIM3PHGDH | |
| SCHEMBL4554742 | 0.71 | MAPK8 (0.31) | ROCK2PIM1PIM3PHGDHMAPK8 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2118066-A1 | FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA | Takeda Pharmaceutical Company Limited (JP) | 2009-11-18 | — | — | EP | disclosed |
| WO-2008099794-A1 | FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2008-08-21 | — | — | WO | disclosed |