Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 8/20 | 0.46 |
| ▸ | DRD4 | P21917 | 5/20 | 0.46 |
| ▸ | DRD2 | P14416 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | HTR1D | P28221 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2005080 | 0.93 | DRD4 (0.49) | HTR1ADRD4DRD2CYP1A2CYP3A4 | |
| SCHEMBL2007262 | 0.91 | HTR1A (0.52) | HTR1ADRD4DRD2CYP1A2CYP3A4 | |
| SCHEMBL2006888 | 0.90 | HTR1A (0.50) | HTR1ADRD4DRD2HTR1DADRA1A | |
| SCHEMBL2005405 | 0.90 | DRD2 (0.51) | HTR1ADRD4DRD2ALDH1A1HTR1D | |
| SCHEMBL2002301 | 0.86 | HTR1A (0.49) | HTR1ADRD4MAPTHSD17B10 | |
| SCHEMBL2005025 | 0.85 | HTR1A (0.54) | HTR1ADRD4DRD2CYP1A2CYP3A4 | |
| SCHEMBL2005541 | 0.85 | HTR1A (0.52) | HTR1ADRD4DRD2HTR1DADRA1A | |
| SCHEMBL2007048 | 0.84 | HTR1A (0.47) | HTR1ADRD4DRD2 | |
| SCHEMBL3144358 | 0.84 | GLS (0.50) | HTR1ADRD4MAPTHSD17B10 | |
| SCHEMBL4687884 | 0.83 | HTR1A (0.52) | HTR1ADRD4DRD2HTR1DADRA1A |
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-1981504-A2 | THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURO DEGENERATIVE DISEASES | NV Remynd (BE) | 2008-10-22 | — | — | EP | claimed |
| WO-2007090617-A2 | THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURO DEGENERATIVE DISEASES | NV REMYND (BE) | 2007-08-16 | — | — | WO | claimed |