Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 14/20 | 0.55 |
| ▸ | DRD4 | P21917 | 3/20 | 0.55 |
| ▸ | DRD5 | P21918 | 3/20 | 0.55 |
| ▸ | DRD3 | P35462 | 3/20 | 0.55 |
| ▸ | HTR1A | P08908 | 11/20 | 0.54 |
| ▸ | HTR2A | P28223 | 11/20 | 0.54 |
| ▸ | HTR7 | P34969 | 11/20 | 0.54 |
| ▸ | HTR6 | P50406 | 11/20 | 0.54 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.51 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.51 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL7748894 | 0.93 | ADRA1D (0.55) | DRD2DRD4DRD5DRD3HTR1A | |
| SCHEMBL7656937 | 0.70 | HRH1 (0.45) | — | |
| SCHEMBL8804131 | 0.69 | DRD2 (0.56) | DRD2DRD4DRD5DRD3HTR1A | |
| SCHEMBL7815142 | 0.69 | DRD2 (0.71) | DRD2DRD4DRD5DRD3HTR1A | |
| Du 125530 SCHEMBL29403202 | 0.69 | HTR1A (0.68) | DRD2DRD4DRD5DRD3HTR1A | |
| Du 125530 SCHEMBL1082516 | 0.69 | HTR1A (0.68) | DRD2DRD4DRD5DRD3HTR1A | |
| SCHEMBL7822015 | 0.68 | DRD2 (0.67) | DRD2DRD4DRD5DRD3HTR1A | |
| SCHEMBL7820656 | 0.68 | HTR1A (0.67) | DRD2DRD4DRD5DRD3HTR1A | |
| Du 125530 SCHEMBL6063602 | 0.68 | HTR1A (0.67) | DRD2DRD4DRD5DRD3HTR1A | |
| SCHEMBL7656122 | 0.68 | HRH1 (0.43) | ADRA1DADRA1AADRA1B |
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-2001022919-A2 | SPIRO[BICYCLIC -AZACYCLOALKYL AND -CYCLOALKYL] DERIVATIVES AND USES THEREOF | MERCK & CO., INC. (US) | 2001-04-05 | — | — | WO | disclosed |