Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 16/20 | 0.80 |
| ▸ | HTR1A | P08908 | 13/20 | 0.80 |
| ▸ | DRD4 | P21917 | 4/20 | 0.57 |
| ▸ | HTR7 | P34969 | 1/20 | 0.47 |
| ▸ | DRD3 | P35462 | 3/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6863614 | 0.79 | DRD2 (0.70) | DRD2HTR1ADRD4HTR7DRD3 | |
| SCHEMBL13533020 | 0.79 | HTR1A (1.00) | DRD2HTR1ADRD4HTR7DRD3 | |
| SCHEMBL13533014 | 0.78 | DRD2 (0.73) | DRD2HTR1ADRD4HTR7DRD3 | |
| SCHEMBL15938505 | 0.78 | DRD4 (0.70) | DRD2HTR1ADRD4HTR7 | |
| SCHEMBL14507216 | 0.77 | HTR1A (0.91) | DRD2HTR1ADRD4HTR7DRD3 | |
| SCHEMBL15937917 | 0.76 | DRD2 (0.69) | DRD2HTR1ADRD4HTR7DRD3 | |
| SCHEMBL13533022 | 0.76 | HTR1A (0.71) | DRD2HTR1ADRD4HTR7DRD3 | |
| SCHEMBL15938316 | 0.76 | DRD4 (0.67) | DRD2HTR1ADRD4HTR7 | |
| SCHEMBL15937598 | 0.75 | DRD4 (0.67) | DRD2HTR1ADRD4DRD3 | |
| SCHEMBL7499884 | 0.75 | DRD4 (0.67) | DRD2HTR1ADRD4HTR7DRD3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011088838-A1 | NOVEL 6,6A,7,8,9,10-HEXAHYDRO-4H-4,8,10A-TRIAZA-ACEPHENANTHRYLENE DERIVATIVES AS DOPAMINE D2 LIGANDS | H. LUNDBECK A/S (DK) | 2011-07-28 | — | — | WO | disclosed |