Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HTR1A | P08908 | 4/20 | 0.46 |
| ▸ | DRD2 | P14416 | 4/20 | 0.46 |
| ▸ | HTR2A | P28223 | 4/20 | 0.46 |
| ▸ | HTR7 | P34969 | 4/20 | 0.46 |
| ▸ | DRD3 | P35462 | 4/20 | 0.46 |
| ▸ | HTR2B | P41595 | 4/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CD44 | P16070 | 1/20 | 0.44 |
| ▸ | HTR5A | P47898 | 1/20 | 0.44 |
| ▸ | HRH1 | P35367 | 2/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL9537328 | 0.77 | SIGMAR1 (0.46) | HTR1ADRD2DRD3 | |
| SCHEMBL9536766 | 0.74 | ALDH1A1 (0.42) | KDM4EALDH1A1LMNADRD2DRD3 | |
| SCHEMBL9538643 | 0.72 | KDM4E (0.45) | KDM4EALDH1A1TDP1LMNAHTR1A | |
| SCHEMBL19273977 | 0.71 | KDM4E (0.67) | KDM4EALDH1A1TDP1LMNAHTR1A | |
| SCHEMBL9536484 | 0.70 | SIGMAR1 (0.47) | HTR1ADRD2 | |
| SCHEMBL9537905 | 0.70 | SIGMAR1 (0.47) | TDP1HTR1ADRD2HTR2AHTR7 | |
| SCHEMBL8914989 | 0.68 | KDM4E (0.61) | KDM4EALDH1A1TDP1LMNAHTR1A | |
| SCHEMBL9535966 | 0.68 | MAPT (0.45) | HTR1ADRD2HTR2AMAPTHTR2C | |
| SCHEMBL8981397 | 0.68 | KDM4E (0.53) | KDM4EALDH1A1TDP1LMNAHTR1A | |
| SCHEMBL8915296 | 0.67 | KDM4E (0.52) | KDM4EALDH1A1TDP1LMNAHTR1A |
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-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 |
| EP-0254623-A1 | Aminoalkylthio triazolopyridine or triazoloquinoline derivatives, process for their preparation, medicaments containing them, particularly useful as antalgics | LABORATOIRES UPSA (FR) | 1988-01-27 | — | — | EP | disclosed |