Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 4/20 | 0.78 |
| ▸ | DRD2 | P14416 | 2/20 | 0.78 |
| ▸ | MAPT | P10636 | 2/20 | 0.72 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.72 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.66 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.66 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.66 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.64 |
| ▸ | GFER | P55789 | 1/20 | 0.59 |
| ▸ | DRD1 | P21728 | 1/20 | 0.59 |
| ▸ | DRD5 | P21918 | 1/20 | 0.59 |
| ▸ | HTR2A | P28223 | 1/20 | 0.59 |
| ▸ | DRD3 | P35462 | 1/20 | 0.59 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.59 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.59 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL8544265 | 0.94 | HTR1A (0.78) | HTR1ADRD2MAPTNPSR1ADRA1D | |
| SCHEMBL6509439 | 0.88 | DRD2 (1.00) | HTR1ADRD2MAPTNPSR1ADRA1D | |
| SCHEMBL7991840 | 0.84 | DRD2 (0.82) | HTR1ADRD2MAPTADRA1DADRA1A | |
| SCHEMBL2766366 | 0.84 | HTR1A (0.78) | HTR1ADRD2MAPTNPSR1SIGMAR1 | |
| SCHEMBL27563249 | 0.84 | HTR1A (0.78) | HTR1ADRD2MAPTNPSR1SIGMAR1 | |
| SCHEMBL7512967 | 0.83 | DRD4 (0.77) | DRD2MAPTSIGMAR1DRD5DRD3 | |
| SCHEMBL7977770 | 0.83 | SIGMAR1 (0.67) | HTR1ADRD2MAPTADRA1DADRA1A | |
| SCHEMBL1298887 | 0.82 | SIGMAR1 (0.73) | MAPTNPSR1SIGMAR1SLC6A4SLC6A3 | |
| SCHEMBL7991490 | 0.81 | SIGMAR1 (0.69) | HTR1ADRD2ADRA1DADRA1AADRA1B | |
| Hydrochloric Acid SCHEMBL1299467 | 0.81 | SIGMAR1 (0.71) | MAPTNPSR1SIGMAR1SLC6A4SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| US-6313297-B1 | CATALYTIC ALKYLATION; BY-PRODUCT INHIBITION | AVENTIS RESEARCH & TECHNOLOGIES (DE) | 2001-11-06 | — | — | US | disclosed |
| EP-1047680-A2 | BASE-CATALYZED SYNTHESIS OF 1-ARYL-4-(ARYL ETHYL)PIPERAZINES FROM AROMATIC OLEFINS AND 1-ARYL PIPERAZINES | Aventis Research & Technologies GmbH & Co KG (DE) | 2000-11-02 | — | — | EP | disclosed |
| WO-1999036412-A2 | BASE-CATALYZED SYNTHESIS OF 1-ARYL-4-(ARYL ETHYL)PIPERAZINES FROM AROMATIC OLEFINS AND 1-ARYL PIPERAZINES | AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO. KG (DE) | 1999-07-22 | — | — | WO | disclosed |