Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 6/20 | 0.89 |
| ▸ | DRD3 | P35462 | 10/20 | 0.83 |
| ▸ | DRD2 | P14416 | 9/20 | 0.78 |
| ▸ | LTA4H | P09960 | 2/20 | 0.70 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.65 |
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 | |
|---|---|---|---|---|
| SCHEMBL5639861 | 0.99 | ACHE (0.89) | ACHEDRD3DRD2LTA4HCHEK2 | |
| SCHEMBL5638746 | 0.93 | ACHE (1.00) | ACHEDRD3DRD2LTA4HCHEK2 | |
| SCHEMBL601512 | 0.91 | DRD3 (1.00) | ACHEDRD3DRD2LTA4H | |
| SCHEMBL9006356 | 0.88 | DRD3 (1.00) | ACHEDRD3DRD2 | |
| SCHEMBL9006337 | 0.87 | DRD3 (1.00) | ACHEDRD3DRD2LTA4H | |
| SCHEMBL21017806 | 0.87 | CHEK2 (0.72) | ACHEDRD3DRD2CHEK2 | |
| SCHEMBL21018072 | 0.86 | CHEK2 (0.74) | ACHEDRD3DRD2CHEK2 | |
| SCHEMBL9006318 | 0.85 | DRD3 (1.00) | ACHEDRD3DRD2 | |
| SCHEMBL9006372 | 0.85 | DRD3 (0.94) | ACHEDRD3DRD2 | |
| SCHEMBL465443 | 0.85 | ACHE (0.75) | ACHEDRD3DRD2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1995030658-A1 | DIMERIC BENZIMIDAZOLE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS DOPAMINERGIC AGENTS, ESP. SELECTIVE FOR THE DOPAMINE D3 RECEPTOR | WARNER-LAMBERT COMPANY (US) | 1995-11-16 | — | — | WO | disclosed |
| US-5414010-A | Dopaminergic blocking agents and psychotic depression | WARNER-LAMBERT COMPANY (US) | 1995-05-09 | — | — | US | disclosed |