Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKD3 | O94806 | 1/20 | 0.54 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.54 |
| ▸ | FRK | P42685 | 1/20 | 0.54 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.54 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.54 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.54 |
| ▸ | GSK3B | P49841 | 1/20 | 0.54 |
| ▸ | PRKD2 | Q9BZL6 | 1/20 | 0.54 |
| ▸ | MAP4K5 | Q9Y4K4 | 1/20 | 0.54 |
| ▸ | MAPK13 | O15264 | 10/20 | 0.54 |
| ▸ | MAPK12 | P53778 | 10/20 | 0.54 |
| ▸ | MAPK11 | Q15759 | 10/20 | 0.54 |
| ▸ | MAPK14 | Q16539 | 10/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | HTR1A | P08908 | 4/20 | 0.51 |
| ▸ | HTR7 | P34969 | 2/20 | 0.48 |
| ▸ | DRD2 | P14416 | 2/20 | 0.48 |
| ▸ | HTR2A | P28223 | 2/20 | 0.48 |
| ▸ | DRD3 | P35462 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL6844082 | 0.81 | MAPK13 (0.69) | MAPK13MAPK12MAPK11MAPK14 | |
| SCHEMBL8417646 | 0.79 | SOAT1 (0.49) | ALDH1A1TSHRHTR1AHTR7DRD2 | |
| SCHEMBL8418073 | 0.79 | DRD2 (0.70) | ALDH1A1TSHRHTR1AHTR7DRD2 | |
| SCHEMBL6847089 | 0.79 | PRKD3 (0.54) | PRKD3MAP4K4FRKMAPK9CSNK1A1 | |
| SCHEMBL8417626 | 0.78 | FAAH (0.51) | ALDH1A1TSHRHTR1AHTR7DRD2 | |
| SCHEMBL8416306 | 0.78 | HTR1A (0.53) | ALDH1A1TSHRHTR1AHTR7DRD2 | |
| SCHEMBL5847870 | 0.76 | SIGMAR1 (0.53) | PRKD3MAP4K4FRKMAPK9CSNK1A1 | |
| SCHEMBL6844336 | 0.76 | MAPK14 (0.64) | PRKD3MAP4K4FRKMAPK9CSNK1A1 | |
| SCHEMBL6161437 | 0.76 | SIGMAR1 (0.55) | PRKD3MAP4K4FRKMAPK9CSNK1A1 | |
| SCHEMBL8418064 | 0.75 | HTR1A (0.59) | HTR1AHTR7DRD2HTR2ADRD3 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0655248-B1 | Use of 1-4-4-aryl(or heteroaryl)-1-piperazinylbutyl-1H-azole derivatives for the preparation of medicaments for the treatment of disorders of gastric secretion | ESTEVE LABOR DR (ES) | 1999-09-15 | — | — | EP | claimed |
| US-5532234-A | Use of 1-[4-[4-aryl (or heteroaryl)-1-piperazinyl]-butyl)-1H-azole derivatives for the preparation of medicaments intended for the treatment of disorders of gastric secretion | LABORATORIES DEL DR. ESTEVE, S.A. (ES) | 1996-07-02 | — | — | US | claimed |
| EP-0502786-B1 | Process for the preparation of aryl(or heteroaryl)-piperazin-1-butyl-azole derivatives | ESTEVE LABOR DR (ES) | 1996-04-24 | — | — | EP | claimed |
| EP-0655248-A1 | Use of 1-4-4-aryl(or heteroaryl)-1-piperazinylbutyl-1H-azole derivatives for the preparation of medicaments for the treatment of disorders of gastric secretion | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 1995-05-31 | — | — | EP | claimed |
| EP-0502786-A1 | Process for the preparation of aryl(or heteroaryl)-piperazin-1-butyl-azole derivatives | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 1992-09-09 | — | — | EP | claimed |