Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 5/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 4/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | DRD1 | P21728 | 1/20 | 0.35 |
| ▸ | DRD5 | P21918 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | TNKS | O95271 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.34 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9537473 | 0.75 | KDM4E (0.46) | HTR1ADRD2DRD1HTR2A | |
| SCHEMBL10572474 | 0.73 | HSD17B10 (0.41) | — | |
| SCHEMBL9540523 | 0.71 | HTR1A (0.48) | HTR1AHRH3DRD2DRD1DRD5 | |
| SCHEMBL9535966 | 0.71 | MAPT (0.45) | HTR1AADRB1DRD2HTR2A | |
| SCHEMBL9538643 | 0.70 | KDM4E (0.45) | HTR1ADRD2HTR2ADRD3 | |
| SCHEMBL9535969 | 0.70 | AR (0.48) | HTR1ADRD2HTR2ADRD3 | |
| SCHEMBL9536766 | 0.70 | ALDH1A1 (0.42) | HRH3DRD2DRD3 | |
| SCHEMBL28070630 | 0.68 | ADRA1B (0.46) | HTR1ADRD2DRD1DRD5HTR2A | |
| SCHEMBL9537865 | 0.68 | SIGMAR1 (0.53) | HTR1ADRD2DRD1HTR2ADRD3 | |
| SCHEMBL9108822 | 0.63 | ADRB1 (0.59) | HTR1AADRB1HTR2APARP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0254623-B1 | AMINOALKYLTHIO TRIAZOLOPYRIDINE OR TRIAZOLOQUINOLINE DERIVATIVES, PROCESS FOR THEIR PREPARATION, MEDICAMENTS CONTAINING THEM, PARTICULARLY USEFUL AS ANTALGICS | LABORATOIRES UPSA (FR) | 1993-06-09 | — | — | EP | disclosed |