Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 7/20 | 0.51 |
| ▸ | HTR1A | P08908 | 4/20 | 0.51 |
| ▸ | DRD2 | P14416 | 4/20 | 0.49 |
| ▸ | HTR2A | P28223 | 2/20 | 0.49 |
| ▸ | DRD3 | P35462 | 2/20 | 0.49 |
| ▸ | DRD1 | P21728 | 1/20 | 0.49 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8419504 | 0.86 | DRD2 (0.54) | HRH3HTR1ADRD2HTR2ADRD3 | |
| SCHEMBL8417620 | 0.83 | HTR1A (0.54) | HRH3HTR1ADRD2HTR2ADRD3 | |
| SCHEMBL8419573 | 0.82 | HTR1A (0.53) | HRH3HTR1ADRD2HTR2ADRD3 | |
| Lesopitron SCHEMBL246589 | 0.81 | HTR1A (0.52) | HTR1ADRD2HTR2ADRD3DRD1 | |
| SCHEMBL8416310 | 0.81 | HTR1A (0.59) | HRH3HTR1ADRD2HTR2ADRD3 | |
| SCHEMBL8416456 | 0.81 | HTR1A (0.52) | HTR1ADRD2HTR2ADRD3DRD1 | |
| Lesopitron SCHEMBL9201343 | 0.80 | HTR1A (0.51) | HTR1ADRD2HTR2ADRD3DRD1 | |
| Lesopitron SCHEMBL1822413 | 0.80 | HTR1A (0.51) | HTR1ADRD2HTR2ADRD3DRD1 | |
| SCHEMBL13532665 | 0.78 | HTR1A (0.52) | HRH3HTR1ADRD2HTR2ADRD3 | |
| SCHEMBL8419641 | 0.78 | HTR1A (0.49) | HRH3HTR1ADRD2HTR2ADRD3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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-0429360-B1 | INHIBITION OF WITHDRAWAL SYNDROME | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 1993-10-13 | — | — | 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 |