Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.55 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | MGLL | Q99685 | 2/20 | 0.49 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.48 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.47 |
| ▸ | DRD4 | P21917 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | GPR6 | P46095 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7214652 | 0.93 | CHRM3 (0.51) | EGLN1CHRM3MGLLHCRTR2PTGER4 | |
| SCHEMBL4086205 | 0.90 | MAPT (0.49) | EGLN1CHRM3MAPTMGLLHCRTR2 | |
| SCHEMBL4092851 | 0.88 | NPY5R (0.51) | MAPTMGLLHCRTR2DRD4HDAC6 | |
| SCHEMBL4081750 | 0.87 | HDAC6 (0.49) | MAPTMGLLHCRTR2DRD4HDAC6 | |
| SCHEMBL4093396 | 0.85 | CHEK2 (0.56) | MAPTMGLLHCRTR2 | |
| SCHEMBL4087270 | 0.83 | DRD4 (0.45) | CHRM3MAPTMGLLHCRTR2ADORA2A | |
| SCHEMBL4099402 | 0.81 | DRD4 (0.46) | MAPTMGLLHCRTR2ADORA2ADRD4 | |
| SCHEMBL5732767 | 0.80 | CHEK2 (0.59) | ALDH1A1 | |
| SCHEMBL4087786 | 0.80 | HCRTR2 (0.47) | MGLLHCRTR2DRD4GPR6 | |
| SCHEMBL5383657 | 0.78 | CHRM3 (0.54) | CHRM3MAPTHCRTR2 |
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-6589954-B1 | Indoles, benzimidazoles and benztriazoles which are substituted at the 5 or 6 position with a substituent comprising an aromatic moiety linked through a piperazine ring to said indole, benzimidazole or benztriazole are useful | SCIOS, INC. | 2003-07-08 | — | — | US | claimed |