Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 3/20 | 0.48 |
| ▸ | DRD2 | P14416 | 6/20 | 0.42 |
| ▸ | DRD4 | P21917 | 3/20 | 0.39 |
| ▸ | DRD3 | P35462 | 2/20 | 0.39 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.39 |
| ▸ | DRD1 | P21728 | 1/20 | 0.37 |
| ▸ | DRD5 | P21918 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3315596 | 0.91 | SIGMAR1 (0.43) | CCR5DRD2 | |
| SCHEMBL3315735 | 0.80 | SIGMAR1 (0.41) | CCR5DRD2 | |
| SCHEMBL3319253 | 0.80 | SIGMAR1 (0.41) | CCR5DRD2 | |
| SCHEMBL3316842 | 0.79 | LMNA (0.44) | — | |
| SCHEMBL3318925 | 0.78 | MC4R (0.43) | — | |
| SCHEMBL3315455 | 0.77 | POLB (0.39) | — | |
| SCHEMBL8219694 | 0.77 | DRD2 (0.48) | CCR5DRD2 | |
| SCHEMBL3316755 | 0.76 | TSHR (0.47) | DRD2DRD4DRD3 | |
| SCHEMBL3317799 | 0.71 | ACHE (0.45) | ACHE | |
| SCHEMBL3318922 | 0.70 | SLC18A3 (0.54) | CCR5DRD2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2066648-B1 | SUBSTITUTED DIMETHYLCYCLOBUTYL COMPOUNDS, THEIR PREPARATION AND USE IN MEDICAMENTS | ESTEVE LABOR DR (ES) | 2017-04-12 | — | — | EP | disclosed |