Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | DRD1 | P21728 | 2/20 | 0.46 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.45 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.45 |
| ▸ | HTR1A | P08908 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 2/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL9538643 | 0.87 | KDM4E (0.45) | KDM4ELMNAADRA1AHTR1AALDH1A1 | |
| SCHEMBL9535969 | 0.87 | AR (0.48) | LMNAADRA1BADRA1AADRA1DHTR1A | |
| SCHEMBL28070630 | 0.78 | ADRA1B (0.46) | DRD1ADRA1BADRA1AADRA1DHTR1A | |
| SCHEMBL9540523 | 0.77 | HTR1A (0.48) | DRD1HTR1AALDH1A1DRD2HTR2A | |
| SCHEMBL9535966 | 0.77 | MAPT (0.45) | HTR1ADRD2HTR2A | |
| SCHEMBL9536717 | 0.75 | HTR1A (0.38) | DRD1HTR1ADRD2HTR2A | |
| SCHEMBL9536766 | 0.74 | ALDH1A1 (0.42) | KDM4ELMNAALDH1A1RAB9ADRD2 | |
| SCHEMBL9537865 | 0.73 | SIGMAR1 (0.53) | DRD1ADRA1AHTR1AALDH1A1DRD2 | |
| SCHEMBL9535704 | 0.72 | KDM4E (0.59) | KDM4ELMNAHTR1AALDH1A1DRD2 | |
| SCHEMBL9537328 | 0.70 | SIGMAR1 (0.46) | HTR1ADRD2 |
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 |