Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 6/20 | 0.64 |
| ▸ | HTR1A | P08908 | 2/20 | 0.62 |
| ▸ | HTR2A | P28223 | 2/20 | 0.62 |
| ▸ | DRD3 | P35462 | 2/20 | 0.62 |
| ▸ | HTR6 | P50406 | 2/20 | 0.62 |
| ▸ | HTR7 | P34969 | 1/20 | 0.62 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.62 |
| ▸ | ACHE | P22303 | 1/20 | 0.61 |
| ▸ | HTR2C | P28335 | 1/20 | 0.60 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.60 |
| ▸ | HRH1 | P35367 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| Water SCHEMBL9075983 | 0.94 | ACHE (0.62) | DRD2HTR1AHTR2ADRD3HTR6 | |
| SCHEMBL793140 | 0.87 | DRD2 (0.70) | DRD2HTR1AHTR2AACHEHTR2C | |
| SCHEMBL791048 | 0.87 | DRD2 (0.70) | DRD2HTR1AHTR2AHTR6HTR7 | |
| Hydrochloric Acid SCHEMBL9596033 | 0.86 | DRD2 (0.69) | DRD2HTR1AHTR2AHTR6HTR7 | |
| SCHEMBL1544931 | 0.85 | ACHE (0.71) | DRD2HTR1AHTR2AACHEHTR2C | |
| Hydrochloric Acid SCHEMBL1545126 | 0.84 | ACHE (0.70) | DRD2HTR1AHTR2AACHEHTR2C | |
| SCHEMBL1545461 | 0.83 | HTR1A (0.76) | DRD2HTR1AHTR2ADRD3HTR6 | |
| SCHEMBL5995122 | 0.81 | HTR1A (0.67) | DRD2HTR1AHTR2A | |
| SCHEMBL7355139 | 0.81 | ACHE (0.68) | DRD2HTR1AHTR2ADRD3HTR6 | |
| SCHEMBL1545289 | 0.81 | ACHE (0.65) | DRD2HTR1AHTR2AACHEHTR2C |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6043240-A | USEFUL AS ANTIPSYCHOTIC AND ANALGESIC AGENTS | HOECHST MARION ROUSSEL, INC. (US) | 2000-03-28 | — | — | US | disclosed |