Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | CTSS | P25774 | 4/20 | 0.34 |
| ▸ | CTSK | P43235 | 4/20 | 0.34 |
| ▸ | CTSL | P07711 | 3/20 | 0.34 |
| ▸ | CTSB | P07858 | 3/20 | 0.34 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CSNK1D | P48730 | 2/20 | 0.32 |
| ▸ | NCS1 | P62166 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | DPP4 | P27487 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.31 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.31 |
| ▸ | ACACB | O00763 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4192273 | 0.84 | MAPK9 (0.39) | MAPK1CTSKALDH1A1NPSR1DPP4 | |
| SCHEMBL7706938 | 0.84 | KMT2A (0.37) | HPGDALDH1A1NPSR1DPP4CYP2D6 | |
| SCHEMBL4186367 | 0.82 | ILK (0.37) | HPGDGAAALDH1A1NPSR1DPP4 | |
| SCHEMBL4192472 | 0.82 | NPC1 (0.46) | ALDH1A1CYP2D6 | |
| SCHEMBL4187924 | 0.82 | RAB9A (0.36) | HPGDMAPK1GAAALDH1A1NPSR1 | |
| SCHEMBL6828604 | 0.81 | IDO1 (0.37) | MAPK1ALDH1A1NPSR1DPP4CYP2D6 | |
| SCHEMBL4199489 | 0.81 | KMT2A (0.37) | MAPK1GAAALDH1A1NPSR1DPP4 | |
| Acetonitrile SCHEMBL7707679 | 0.80 | RAB9A (0.35) | HPGDMAPK1GAAALDH1A1NPSR1 | |
| SCHEMBL4197422 | 0.80 | SMN1; SMN2 (0.41) | HPGDGAAALDH1A1CYP2D6 | |
| SCHEMBL4187935 | 0.80 | ILK (0.38) | MAPK1ALDH1A1CYP2D6 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2026802-A2 | JNK INHIBITORS FOR TREATMENT OF SKIN DISEASES | Laboratoires Serono SA (CH) | 2009-02-25 | — | — | EP | disclosed |
| EP-1904181-A2 | JNK INHIBITORS FOR THE TREATMENT OF ENDOMETREOSIS | LABORATOIRES SERONO S.A. (CH) | 2008-04-02 | — | — | EP | disclosed |
| WO-2007141224-A2 | JNK INHIBITORS FOR TREATMENT OF SKIN DISEASES | LABORATOIRES SERONO SA (CH) | 2007-12-13 | — | — | WO | disclosed |
| WO-2007011762-A2 | JNK INHIBITORS FOR THE TREATMENT OF ENDOMETREOSIS | LABORATOIRES SERONO S.A. (CH) | 2007-01-25 | — | — | WO | disclosed |