Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 4/20 | 0.57 |
| ▸ | CHKA | P35790 | 1/20 | 0.50 |
| ▸ | HTR3A | P46098 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | PTK2B | Q14289 | 2/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | SUV39H2 | Q9H5I1 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | TP53BP1 | Q12888 | 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 | |
|---|---|---|---|---|
| SCHEMBL20884918 | 0.85 | KDM4E (0.51) | DRD4HTR3AKDM4EMAPTGAA | |
| SCHEMBL14922272 | 0.85 | CHKA (0.54) | DRD4CHKAHTR3AKDM4EMAPT | |
| SCHEMBL844235 | 0.84 | DRD4 (0.58) | DRD4KDM4EMAPTGAAMAPK1 | |
| SCHEMBL7916691 | 0.83 | DRD4 (0.53) | DRD4MAPTGAAMAPK1HTT | |
| SCHEMBL11252062 | 0.83 | DRD4 (0.54) | DRD4KDM4EMAPTMAPK1HTT | |
| SCHEMBL31204287 | 0.83 | DRD4 (0.48) | DRD4CHKAHTR3AKDM4EMAPT | |
| SCHEMBL10968988 | 0.82 | DRD4 (0.56) | DRD4MAPTMAPK1HTTRECQL | |
| SCHEMBL8325286 | 0.81 | AGXT (0.44) | DRD4HTR3AKDM4EMAPTGAA | |
| SCHEMBL11004107 | 0.81 | ADRB1 (0.65) | DRD4HTR3AHTTSUV39H2 | |
| SCHEMBL14922279 | 0.81 | CHKA (0.50) | DRD4CHKAHTR3AKDM4EMAPT |
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-0011857-B1 | 2-CHLORO-4-(4-LOWER ALKYL-1-PIPERAZINYL)-BENZENEMETHANOL-NW-OXIDES, METHODS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | Edna McConnell Clark Foundation (US) | 1982-02-03 | — | — | EP | disclosed |
| US-4234583-A | SCHISTOSOMIASIS | EDNA MCCONNELL CLARK FOUNDATION (US) | 1980-11-18 | — | — | US | disclosed |
| EP-0011857-A1 | 2-Chloro-4-(4-lower alkyl-1-piperazinyl)-benzenemethanol-Nw-oxides, methods for their preparation and pharmaceutical compositions containing them | Edna McConnell Clark Foundation (US) | 1980-06-11 | — | — | EP | disclosed |