Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.61 |
| ▸ | MAPT | P10636 | 1/20 | 0.61 |
| ▸ | IDO1 | P14902 | 5/20 | 0.56 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.42 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.38 |
| ▸ | MTOR | P42345 | 1/20 | 0.38 |
| ▸ | ADK | P55263 | 1/20 | 0.38 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL18731063 | 0.86 | KDM4E (0.43) | KDM4ECYP3A4MAPTIDO1DYRK1A | |
| SCHEMBL31484649 | 0.79 | NISCH (0.41) | KDM4ECYP3A4MAPTIDO1MAPK14 | |
| SCHEMBL224770 | 0.76 | KDM4E (1.00) | KDM4ECYP3A4MAPTIDO1DYRK1A | |
| SCHEMBL10397990 | 0.75 | KDM4E (0.79) | KDM4ECYP3A4MAPTIDO1MAPK14 | |
| Bromide SCHEMBL31020961 | 0.74 | KDM4E (0.96) | KDM4ECYP3A4MAPTIDO1DYRK1A | |
| SCHEMBL1501808 | 0.74 | KDM4E (0.61) | KDM4ECYP3A4MAPTIDO1DYRK1A | |
| SCHEMBL11000595 | 0.74 | CYP3A4 (0.61) | KDM4ECYP3A4MAPTIDO1DYRK1A | |
| SCHEMBL8117441 | 0.74 | KDM4E (0.61) | KDM4ECYP3A4MAPTIDO1DYRK1A | |
| SCHEMBL18730921 | 0.72 | IDO1 (0.51) | CYP3A4MAPTIDO1POLB | |
| Hydrochloric Acid SCHEMBL7430812 | 0.72 | CYP3A4 (0.58) | KDM4ECYP3A4MAPTIDO1DYRK1A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101501004-A | Compounds and compositions as HEDGEHOG pathway modulators | IRM LLC (VG) | 2009-08-05 | — | — | CN | disclosed |
| EP-0365030-B1 | Imidazole compound and process for preparing the same | ISHIHARA SANGYO KAISHA (JP) | 1994-01-26 | — | — | EP | disclosed |
| US-5023336-A | Fungicides, biocides | ISHIHARA SANGYO KAISHA LTD. (JP) | 1991-06-11 | — | — | US | disclosed |