Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 6/20 | 0.86 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.86 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.86 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.86 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.86 |
| ▸ | MAPT | P10636 | 1/20 | 0.86 |
| ▸ | HPGD | P15428 | 1/20 | 0.86 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.86 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.86 |
| ▸ | DRD4 | P21917 | 9/20 | 0.70 |
| ▸ | DRD2 | P14416 | 7/20 | 0.68 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.62 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.59 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.59 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.59 |
| ▸ | DRD3 | P35462 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9639153 | 0.99 | HTR1A (0.85) | HTR1AKDM4EALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL6364443 | 0.93 | HTR1A (1.00) | HTR1AKDM4EALDH1A1CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL3187184 | 0.92 | HTR1A (0.98) | HTR1AKDM4EALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL9280223 | 0.87 | HTR1A (0.68) | HTR1AKDM4EALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL9843330 | 0.86 | HTR1A (0.88) | HTR1AKDM4EALDH1A1CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL9640147 | 0.86 | HTR1A (0.87) | HTR1AKDM4EALDH1A1CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL9640508 | 0.86 | HTR1A (0.67) | HTR1AKDM4EALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL10911336 | 0.81 | DRD2 (1.00) | HTR1ADRD4DRD2ADRA2AADRA1D | |
| SCHEMBL9198697 | 0.81 | HTR1A (0.76) | HTR1AKDM4EALDH1A1CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL9639119 | 0.80 | HTR1A (0.75) | HTR1AKDM4EALDH1A1CYP1A2CYP3A4 |
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-0434561-B1 | 1-Naphthyl-piperazine derivatives, process for their preparation and pharmaceutical compositions containing them | ADIR (FR) | 1995-10-18 | — | — | EP | disclosed |
| EP-0434561-A2 | 1-Naphthyl-piperazine derivatives, process for their preparation and pharmaceutical compositions containing them | ADIR ET COMPAGNIE (FR) | 1991-06-26 | — | — | EP | disclosed |