Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.48 |
| ▸ | DRD4 | P21917 | 1/20 | 0.48 |
| ▸ | CXCR4 | P61073 | 5/20 | 0.44 |
| ▸ | ACHE | P22303 | 5/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | BCHE | P06276 | 3/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9302163 | 0.78 | CXCR4 (0.56) | DRD2DRD4CXCR4ACHEBACE1 | |
| SCHEMBL17754013 | 0.77 | CXCR4 (0.56) | DRD2DRD4CXCR4ACHEBACE1 | |
| SCHEMBL9301443 | 0.71 | CXCR4 (0.65) | DRD2DRD4CXCR4ACHEBACE1 | |
| SCHEMBL19658389 | 0.71 | ACHE (0.58) | DRD2DRD4CXCR4ACHE | |
| SCHEMBL6524716 | 0.70 | CXCR4 (0.58) | DRD2DRD4CXCR4ACHEBACE1 | |
| SCHEMBL14492265 | 0.70 | CXCR4 (0.62) | DRD2DRD4CXCR4ACHEBACE1 | |
| SCHEMBL19652186 | 0.69 | CXCR4 (0.50) | DRD2DRD4CXCR4ACHEBCHE | |
| SCHEMBL9302815 | 0.69 | ADRA1D (0.58) | DRD2DRD4CXCR4ACHEBACE1 | |
| SCHEMBL9303177 | 0.68 | CXCR4 (0.60) | DRD2DRD4CXCR4ACHEBACE1 | |
| SCHEMBL156415 | 0.68 | ACHE (0.67) | CXCR4ACHEBACE1BCHE |
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 |
|---|---|---|---|---|---|---|---|
| US-5286735-A | Antidepressants, anxiolytic agents | PIERRE FABRE MEDICAMENT (FR) | 1994-02-15 | — | — | US | claimed |
| US-5286735-A | Antidepressants, anxiolytic agents | PIERRE FABRE MEDICAMENT (FR) | 1994-02-15 | — | — | US | disclosed |